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

Systemtic Name: methyl 4-[[[(1R)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-(phenylsulfonyl)amino]methyl]benzoate Openeye Name: methyl 4-[[[(1R)-2-amino-2-oxo-1-phenyl-ethyl]-(benzenesulfonyl)amino]methyl]benzoate CAS Name: 4-[[[(1R)-2-amino-2-oxo-1-phenylethyl]-(benzenesulfonyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(1R)-2-amino-2-oxo-1-phenylethyl]-(benzenesulfonyl)amino]methyl]benzoate Traditional Name: 4-[[[(1R)-2-amino-2-keto-1-phenyl-ethyl]-besyl-amino]methyl]benzoic acid methyl ester Formula: C23H22N2O5S MolecularWeight: 438.49618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O5S/c1-30-23(27)19-14-12-17(13-15-19)16-25(31(28,29)20-10-6-3-7-11-20)21(22(24)26)18-8-4-2-5-9-18/h2-15,21H,16H2,1H3,(H2,24,26)/t21-/m1/s1