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

Systemtic Name: methyl 3-[2-[(2-chlorophenyl)-(phenylsulfonyl)amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[N-(benzenesulfonyl)-2-chloro-anilino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-2-chloroanilino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[N-(benzenesulfonyl)-2-chloroanilino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(N-besyl-2-chloro-anilino)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=CC=C3

InChI

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