Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H11N2O3.Na.H2O |
| Molecular Weight | 272.2324 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[Na+].CCN1C=C(C([O-])=O)C(=O)C2=C1N=C(C)C=C2
InChI
InChIKey=OWEXQJSSKQXXSX-UHFFFAOYSA-M
InChI=1S/C12H12N2O3.Na.H2O/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14;;/h4-6H,3H2,1-2H3,(H,16,17);;1H2/q;+1;/p-1
Approval Year
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NCI_THESAURUS |
C795
Created by
admin on Fri Dec 15 15:03:20 UTC 2023 , Edited by admin on Fri Dec 15 15:03:20 UTC 2023
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J17QL41ZAG
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C80641
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300000040300
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CHEMBL5
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15769-77-4
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23675318
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DTXSID50935777
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SUB14627MIG
Created by
admin on Fri Dec 15 15:03:20 UTC 2023 , Edited by admin on Fri Dec 15 15:03:20 UTC 2023
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PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
