4,5-dimethoxy-2-[(phenylmethyl)sulfonylamino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[(phenylmethyl)sulfonylamino]benzoic acid Openeye Name: 2-(benzylsulfonylamino)-4,5-dimethoxy-benzoic acid CAS Name: 4,5-dimethoxy-2-[(phenylmethyl)sulfonylamino]benzoic acid IUPAC Name: 2-(benzylsulfonylamino)-4,5-dimethoxybenzoic acid Traditional Name: 2-(benzylsulfonylamino)-4,5-dimethoxy-benzoic acid Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)CC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)CC2=CC=CC=C2)OC

InChI

InChI=1S/C16H17NO6S/c1-22-14-8-12(16(18)19)13(9-15(14)23-2)17-24(20,21)10-11-6-4-3-5-7-11/h3-9,17H,10H2,1-2H3,(H,18,19)