(1-methylpiperidin-3-yl) 1-phenylisoquinoline-4-carboxylate

Systemtic Name: (1-methylpiperidin-3-yl) 1-phenylisoquinoline-4-carboxylate Openeye Name: (1-methyl-3-piperidyl) 1-phenylisoquinoline-4-carboxylate CAS Name: 1-phenyl-4-isoquinolinecarboxylic acid (1-methyl-3-piperidinyl) ester IUPAC Name: (1-methylpiperidin-3-yl) 1-phenylisoquinoline-4-carboxylate Traditional Name: 1-phenylisoquinoline-4-carboxylic acid (1-methyl-3-piperidyl) ester Formula: C22H22N2O2 MolecularWeight: 346.42228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)OC(=O)C2=CN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CN1CCCC(C1)OC(=O)C2=CN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O2/c1-24-13-7-10-17(15-24)26-22(25)20-14-23-21(16-8-3-2-4-9-16)19-12-6-5-11-18(19)20/h2-6,8-9,11-12,14,17H,7,10,13,15H2,1H3