dimethyl 5-[2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[benzenesulfonyl-(phenylmethyl)amino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[benzenesulfonyl(benzyl)amino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[benzyl(besyl)amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O7S/c1-33-24(29)19-13-20(25(30)34-2)15-21(14-19)26-23(28)17-27(16-18-9-5-3-6-10-18)35(31,32)22-11-7-4-8-12-22/h3-15H,16-17H2,1-2H3,(H,26,28)