methyl 2-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-[(4-ethoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-ethoxyphenyl)sulfonyl-methylamino]acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 4,5-dimethoxy-2-[[2-[methyl(p-phenetylsulfonyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C21H26N2O8S MolecularWeight: 466.50474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C21H26N2O8S/c1-6-31-14-7-9-15(10-8-14)32(26,27)23(2)13-20(24)22-17-12-19(29-4)18(28-3)11-16(17)21(25)30-5/h7-12H,6,13H2,1-5H3,(H,22,24)