methyl 4,5-dimethoxy-2-[2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-[benzenesulfonyl-(phenylmethyl)amino]-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-[benzyl(besyl)amino]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C25H26N2O7S/c1-32-22-14-20(25(29)34-3)21(15-23(22)33-2)26-24(28)17-27(16-18-10-6-4-7-11-18)35(30,31)19-12-8-5-9-13-19/h4-15H,16-17H2,1-3H3,(H,26,28)