Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C29H24F4N2O3.C7H8O3S |
Molecular Weight | 696.708 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.[H][C@@]2(OC3=C(C=CC(=C3)C(F)(F)F)C4=C2C5=C(C=C(O)C=C5)N=C4)C6=CC=C(OCCN7CC(CF)C7)C=C6
InChI
InChIKey=WOXQMUXFSMQUSS-LNLSOMNWSA-N
InChI=1S/C29H24F4N2O3.C7H8O3S/c30-13-17-15-35(16-17)9-10-37-21-5-1-18(2-6-21)28-27-23-8-4-20(36)12-25(23)34-14-24(27)22-7-3-19(29(31,32)33)11-26(22)38-28;1-6-2-4-7(5-3-6)11(8,9)10/h1-8,11-12,14,17,28,36H,9-10,13,15-16H2;2-5H,1H3,(H,8,9,10)/t28-;/m1./s1
Molecular Formula | C29H24F4N2O3 |
Molecular Weight | 524.5061 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C7H8O3S |
Molecular Weight | 172.202 |
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 14:54:07 GMT 2023
by
admin
on
Sat Dec 16 14:54:07 GMT 2023
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Record UNII |
F7UDT90EW5
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Record Status |
Validated (UNII)
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Record Version |
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-
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156620226
Created by
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300000005402
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admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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2408840-41-3
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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C186400
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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F7UDT90EW5
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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JK-56
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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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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