methyl 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: methyl 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: methyl 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 2-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoic acid methyl ester Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)[C@H](CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O5S/c1-31-23(28)19-9-5-6-10-20(19)25-22(27)21(15-16-7-3-2-4-8-16)26-32(29,30)18-13-11-17(24)12-14-18/h2-14,21,26H,15H2,1H3,(H,25,27)/t21-/m0/s1