3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid

Systemtic Name: 3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid Openeye Name: 3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid CAS Name: 3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid IUPAC Name: 3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid Traditional Name: 3-[[(3,4-dimethoxyphenyl)sulfonylamino]methyl]benzoic acid Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC(=C2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC(=C2)C(=O)O)OC

InChI

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