Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H33ClN2O3.ClH |
| Molecular Weight | 553.519 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)[C@@H](N(CCCN)C(=O)C1=CC=C(C)C=C1)C2=C(CC3=CC=CC=C3)C(=O)C4=CC=C(Cl)C=C4O2
InChI
InChIKey=MLMZVWABFOLFGV-LNLSOMNWSA-N
InChI=1S/C31H33ClN2O3.ClH/c1-20(2)28(34(17-7-16-33)31(36)23-12-10-21(3)11-13-23)30-26(18-22-8-5-4-6-9-22)29(35)25-15-14-24(32)19-27(25)37-30;/h4-6,8-15,19-20,28H,7,16-18,33H2,1-3H3;1H/t28-;/m1./s1
| Molecular Formula | C31H33ClN2O3 |
| Molecular Weight | 517.058 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:40:17 GMT 2023
by
admin
on
Sat Dec 16 13:40:17 GMT 2023
|
| Record UNII |
2YW6FB68GM
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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940929-33-9
Created by
admin on Sat Dec 16 13:40:17 GMT 2023 , Edited by admin on Sat Dec 16 13:40:17 GMT 2023
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2YW6FB68GM
Created by
admin on Sat Dec 16 13:40:17 GMT 2023 , Edited by admin on Sat Dec 16 13:40:17 GMT 2023
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49867937
Created by
admin on Sat Dec 16 13:40:17 GMT 2023 , Edited by admin on Sat Dec 16 13:40:17 GMT 2023
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DTXSID80678822
Created by
admin on Sat Dec 16 13:40:17 GMT 2023 , Edited by admin on Sat Dec 16 13:40:17 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
SOLVATE->ANHYDROUS | |||
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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