Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H24N2.C7H8O3S |
Molecular Weight | 452.609 |
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.CNCCC[C@@]2(C)CN(C3=C2C=CC=C3)C4=CC=CC=C4
InChI
InChIKey=HCIFDIMOPGHYSI-FYZYNONXSA-N
InChI=1S/C19H24N2.C7H8O3S/c1-19(13-8-14-20-2)15-21(16-9-4-3-5-10-16)18-12-7-6-11-17(18)19;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,9-12,20H,8,13-15H2,1-2H3;2-5H,1H3,(H,8,9,10)/t19-;/m0./s1
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 |
Molecular Formula | C19H24N2 |
Molecular Weight | 280.4073 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:53:45 GMT 2023
by
admin
on
Sat Dec 16 10:53:45 GMT 2023
|
Record UNII |
10AB61JERH
|
Record Status |
Validated (UNII)
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Record Version |
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-
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10AB61JERH
Created by
admin on Sat Dec 16 10:53:45 GMT 2023 , Edited by admin on Sat Dec 16 10:53:45 GMT 2023
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76972864
Created by
admin on Sat Dec 16 10:53:45 GMT 2023 , Edited by admin on Sat Dec 16 10:53:45 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |