(4-oxidanylidene-4-phenyl-butyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (4-oxo-4-phenyl-butyl) 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid (4-keto-4-phenyl-butyl) ester Formula: C23H27NO5S MolecularWeight: 429.52918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27NO5S/c1-18-13-15-24(16-14-18)30(27,28)21-11-9-20(10-12-21)23(26)29-17-5-8-22(25)19-6-3-2-4-7-19/h2-4,6-7,9-12,18H,5,8,13-17H2,1H3