3,4,5-trimethoxy-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzoic acid

Systemtic Name: 3,4,5-trimethoxy-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzoic acid Openeye Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-3,4,5-trimethoxy-benzoic acid CAS Name: 3,4,5-trimethoxy-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzoic acid IUPAC Name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-3,4,5-trimethoxybenzoic acid Traditional Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-3,4,5-trimethoxy-benzoic acid Formula: C24H25NO8S MolecularWeight: 487.5222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=C(C(=C(C=C3C(=O)O)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=C(C(=C(C=C3C(=O)O)OC)OC)OC

InChI

InChI=1S/C24H25NO8S/c1-30-17-10-12-18(13-11-17)34(28,29)25(15-16-8-6-5-7-9-16)21-19(24(26)27)14-20(31-2)22(32-3)23(21)33-4/h5-14H,15H2,1-4H3,(H,26,27)