(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C19H21NO5S2/c1-14-8-10-20(11-9-14)27(23,24)16-6-4-15(5-7-16)19(22)25-13-17(21)18-3-2-12-26-18/h2-7,12,14H,8-11,13H2,1H3