SpectraBase Compound ID | 4xquXPyfJSw |
---|---|
InChI | InChI=1S/C13H12N2O4S/c14-10-6-2-4-8-12(10)20(18,19)15-11-7-3-1-5-9(11)13(16)17/h1-8,15H,14H2,(H,16,17) |
InChIKey | TVDMXSUSGZCCCL-UHFFFAOYSA-N |
Mol Weight | 292.31 g/mol |
Molecular Formula | C13H12N2O4S |
Exact Mass | 292.051778 g/mol |
SpectraBase Spectrum ID | 85UpKw17aDd |
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Name | Benzoic acid, 2-[[(2-aminophenyl)sulfonyl]amino]- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 292.051778044 u |
Formula | C13H12N2O4S |
InChI | InChI=1S/C13H12N2O4S/c14-10-6-2-4-8-12(10)20(18,19)15-11-7-3-1-5-9(11)13(16)17/h1-8,15H,14H2,(H,16,17) |
InChIKey | TVDMXSUSGZCCCL-UHFFFAOYSA-N |
SMILES | C1=C(C(N)=CC=C1)S(NC=1C=CC=CC1C(O)=O)(=O)=O |