3-(methylcarbamoyl)benzenesulfonic acid

Systemtic Name: 3-(methylcarbamoyl)benzenesulfonic acid Openeye Name: 3-(methylcarbamoyl)benzenesulfonic acid CAS Name: 3-(methylcarbamoyl)benzenesulfonic acid IUPAC Name: 3-(methylcarbamoyl)benzenesulfonic acid Traditional Name: 3-(methylcarbamoyl)besylic acid Formula: C8H9NO4S MolecularWeight: 215.22636

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)S(=O)(=O)O

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C8H9NO4S/c1-9-8(10)6-3-2-4-7(5-6)14(11,12)13/h2-5H,1H3,(H,9,10)(H,11,12,13)