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

Systemtic Name: dimethyl 5-[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C

InChI

InChI=1S/C21H24N2O7S/c1-13-6-7-18(8-14(13)2)31(27,28)23(3)12-19(24)22-17-10-15(20(25)29-4)9-16(11-17)21(26)30-5/h6-11H,12H2,1-5H3,(H,22,24)