Details
Stereochemistry | RACEMIC |
Molecular Formula | C26H20Cl4FN2O2.Cl |
Molecular Weight | 588.713 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].FC1=CC=C(C=C1)C(=O)C[N+]2=CN(CC(OCC3=CC=C(Cl)C=C3Cl)C4=CC=C(Cl)C=C4Cl)C=C2
InChI
InChIKey=JWPMAPBNVNRWBX-UHFFFAOYSA-M
InChI=1S/C26H20Cl4FN2O2.ClH/c27-19-4-1-18(23(29)11-19)15-35-26(22-8-5-20(28)12-24(22)30)14-33-10-9-32(16-33)13-25(34)17-2-6-21(31)7-3-17;/h1-12,16,26H,13-15H2;1H/q+1;/p-1
Molecular Formula | C26H20Cl4FN2O2 |
Molecular Weight | 553.26 |
Charge | 1 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:13:12 UTC 2023
by
admin
on
Fri Dec 15 16:13:12 UTC 2023
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Record UNII |
039G8U30HE
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C28394
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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Code System | Code | Type | Description | ||
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3788
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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100000081255
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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039G8U30HE
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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SUB07679MIG
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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CHEMBL2111070
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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351149
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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216228
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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C65708
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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53597-28-7
Created by
admin on Fri Dec 15 16:13:12 UTC 2023 , Edited by admin on Fri Dec 15 16:13:12 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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PARENT -> SALT/SOLVATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |