methyl 3-[[[(1R)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate

Systemtic Name: methyl 3-[[[(1R)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate Openeye Name: methyl 3-[[[(1R)-2-amino-2-oxo-1-phenyl-ethyl]-(4-chlorophenyl)sulfonyl-amino]methyl]benzoate CAS Name: 3-[[[(1R)-2-amino-2-oxo-1-phenylethyl]-(4-chlorophenyl)sulfonylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[[(1R)-2-amino-2-oxo-1-phenylethyl]-(4-chlorophenyl)sulfonylamino]methyl]benzoate Traditional Name: 3-[[[(1R)-2-amino-2-keto-1-phenyl-ethyl]-(4-chlorophenyl)sulfonyl-amino]methyl]benzoic acid methyl ester Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN(C(C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN([C@H](C2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O5S/c1-31-23(28)18-9-5-6-16(14-18)15-26(21(22(25)27)17-7-3-2-4-8-17)32(29,30)20-12-10-19(24)11-13-20/h2-14,21H,15H2,1H3,(H2,25,27)/t21-/m1/s1