[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] pyridine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] pyridine-4-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C20H22N2O3 MolecularWeight: 338.40028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=NC=C3

InChI

InChI=1S/C20H22N2O3/c23-19(15-25-20(24)18-6-10-21-11-7-18)22-12-8-17(9-13-22)14-16-4-2-1-3-5-16/h1-7,10-11,17H,8-9,12-15H2