Details
Stereochemistry | RACEMIC |
Molecular Formula | C13H13N2O3.Na |
Molecular Weight | 268.2437 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC(=O)NC(CC1=CNC2=C1C=CC=C2)C([O-])=O
InChI
InChIKey=UQSHZBSQKMVQBS-UHFFFAOYSA-M
InChI=1S/C13H14N2O3.Na/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11;/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18);/q;+1/p-1
Molecular Formula | C13H13N2O3 |
Molecular Weight | 245.2539 |
Charge | -1 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
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 15:25:10 UTC 2023
by
admin
on
Fri Dec 15 15:25:10 UTC 2023
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Record UNII |
3EN9H0M2FX
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Record Status |
Validated (UNII)
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Record Version |
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-
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62307-74-8
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3EN9H0M2FX
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SUB122725
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C45678
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CONCEPT | Industrial Aid | ||
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DTXSID60977865
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3EN9H0M2FX
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100000145077
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263-497-5
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1366816
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23684903
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C80910
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |