dimethyl 5-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(4-ethoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(4-ethoxyphenyl)sulfonyl-methylamino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[methyl(p-phenetylsulfonyl)amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H24N2O8S MolecularWeight: 464.48886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H24N2O8S/c1-5-31-17-6-8-18(9-7-17)32(27,28)23(2)13-19(24)22-16-11-14(20(25)29-3)10-15(12-16)21(26)30-4/h6-12H,5,13H2,1-4H3,(H,22,24)