methyl 2-[2-[(3-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(3-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[3-chloro-N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-[[2-(3-chloro-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-chloro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(3-chloro-N-tosyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C23H21ClN2O5S MolecularWeight: 472.94124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)OC)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)OC)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H21ClN2O5S/c1-16-10-12-19(13-11-16)32(29,30)26(18-7-5-6-17(24)14-18)15-22(27)25-21-9-4-3-8-20(21)23(28)31-2/h3-14H,15H2,1-2H3,(H,25,27)