methyl 4-chloranyl-3-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[[4-[methyl(p-tolylsulfonyl)amino]benzoyl]amino]benzoate CAS Name: 4-chloro-3-[[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate Traditional Name: 4-chloro-3-[[4-[methyl(tosyl)amino]benzoyl]amino]benzoic acid methyl ester Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)Cl

InChI

InChI=1S/C23H21ClN2O5S/c1-15-4-11-19(12-5-15)32(29,30)26(2)18-9-6-16(7-10-18)22(27)25-21-14-17(23(28)31-3)8-13-20(21)24/h4-14H,1-3H3,(H,25,27)