Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H25N2O4.CH3O4S |
Molecular Weight | 492.542 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COS([O-])(=O)=O.C[N+]4(CCCNC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(O)C=C1)CCOCC4
InChI
InChIKey=JAADWTSKUWWHLE-UHFFFAOYSA-N
InChI=1S/C22H24N2O4.CH4O4S/c1-24(11-13-28-14-12-24)10-4-9-23-17-7-8-18(25)20-19(17)21(26)15-5-2-3-6-16(15)22(20)27;1-5-6(2,3)4/h2-3,5-8H,4,9-14H2,1H3,(H-,23,25,26,27);1H3,(H,2,3,4)
Molecular Formula | CH3O4S |
Molecular Weight | 111.097 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C22H25N2O4 |
Molecular Weight | 381.4449 |
Charge | 1 |
Count |
|
Stereochemistry | RACEMIC |
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 19:59:21 GMT 2023
by
admin
on
Sat Dec 16 19:59:21 GMT 2023
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Record UNII |
RNJ1LHE5O7
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Record Status |
Validated (UNII)
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Record Version |
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-
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38866-20-5
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RNJ1LHE5O7
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254-161-9
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admin on Sat Dec 16 19:59:21 GMT 2023 , Edited by admin on Sat Dec 16 19:59:21 GMT 2023
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DTXSID80192119
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admin on Sat Dec 16 19:59:21 GMT 2023 , Edited by admin on Sat Dec 16 19:59:21 GMT 2023
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16205112
Created by
admin on Sat Dec 16 19:59:21 GMT 2023 , Edited by admin on Sat Dec 16 19:59:21 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |