Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C11H16N2O3S.H2O |
| Molecular Weight | 274.337 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.CC1=CC(=C(C=C1)N2CCNCC2)S(O)(=O)=O
InChI
InChIKey=ZRQKZWAOIRVBFD-UHFFFAOYSA-N
InChI=1S/C11H16N2O3S.H2O/c1-9-2-3-10(11(8-9)17(14,15)16)13-6-4-12-5-7-13;/h2-3,8,12H,4-7H2,1H3,(H,14,15,16);1H2
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C11H16N2O3S |
| Molecular Weight | 256.321 |
| 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
Fri Dec 15 15:49:11 UTC 2023
by
admin
on
Fri Dec 15 15:49:11 UTC 2023
|
| Record UNII |
2SH110E854
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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DTXSID20431256
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admin on Fri Dec 15 15:49:11 UTC 2023 , Edited by admin on Fri Dec 15 15:49:11 UTC 2023
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DBSALT002435
Created by
admin on Fri Dec 15 15:49:11 UTC 2023 , Edited by admin on Fri Dec 15 15:49:11 UTC 2023
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192509-24-3
Created by
admin on Fri Dec 15 15:49:11 UTC 2023 , Edited by admin on Fri Dec 15 15:49:11 UTC 2023
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2SH110E854
Created by
admin on Fri Dec 15 15:49:11 UTC 2023 , Edited by admin on Fri Dec 15 15:49:11 UTC 2023
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9816981
Created by
admin on Fri Dec 15 15:49:11 UTC 2023 , Edited by admin on Fri Dec 15 15:49:11 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
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ACTIVE MOIETY |