(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3,4-dimethyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3,4-dimethyl-5-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3,4-dimethyl-5-(4-methylpiperidino)sulfonyl-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C23H28N2O5S MolecularWeight: 444.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C23H28N2O5S/c1-15-9-11-25(12-10-15)31(28,29)20-14-19(13-16(2)17(20)3)23(27)30-21(22(24)26)18-7-5-4-6-8-18/h4-8,13-15,21H,9-12H2,1-3H3,(H2,24,26)