2-(methylamino)-4-sulfo-benzoic acid

Systemtic Name: 2-(methylamino)-4-sulfo-benzoic acid Openeye Name: 2-(methylamino)-4-sulfo-benzoic acid CAS Name: 2-(methylamino)-4-sulfobenzoic acid IUPAC Name: 2-(methylamino)-4-sulfobenzoic acid Traditional Name: 2-(methylamino)-4-sulfo-benzoic acid Formula: C8H9NO5S MolecularWeight: 231.22576

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)S(=O)(=O)O)C(=O)O

Isomeric SMILES

CNC1=C(C=CC(=C1)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C8H9NO5S/c1-9-7-4-5(15(12,13)14)2-3-6(7)8(10)11/h2-4,9H,1H3,(H,10,11)(H,12,13,14)