4-(4-methylphenyl)-N-[3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]piperidine-1-carboxamide

Systemtic Name: 4-(4-methylphenyl)-N-[3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]piperidine-1-carboxamide Openeye Name: 4-(p-tolyl)-N-[3-(pyrrolidin-1-ylmethyl)-7-quinolyl]piperidine-1-carboxamide CAS Name: 4-(4-methylphenyl)-N-[3-(1-pyrrolidinylmethyl)-7-quinolinyl]-1-piperidinecarboxamide IUPAC Name: 4-(4-methylphenyl)-N-[3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]piperidine-1-carboxamide Traditional Name: 4-(p-tolyl)-N-[3-(pyrrolidinomethyl)-7-quinolyl]piperidine-1-carboxamide Formula: C27H32N4O MolecularWeight: 428.56918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(CC2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(CC2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCC5

InChI

InChI=1S/C27H32N4O/c1-20-4-6-22(7-5-20)23-10-14-31(15-11-23)27(32)29-25-9-8-24-16-21(18-28-26(24)17-25)19-30-12-2-3-13-30/h4-9,16-18,23H,2-3,10-15,19H2,1H3,(H,29,32)