4-(4-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-N-quinolin-6-yl-piperidine-1-carboxamide

Systemtic Name: 4-(4-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-N-quinolin-6-yl-piperidine-1-carboxamide Openeye Name: 4-(p-tolyl)-2-(pyrrolidin-1-ylmethyl)-N-(6-quinolyl)piperidine-1-carboxamide CAS Name: 4-(4-methylphenyl)-2-(1-pyrrolidinylmethyl)-N-(6-quinolinyl)-1-piperidinecarboxamide IUPAC Name: 4-(4-methylphenyl)-2-(pyrrolidin-1-ylmethyl)-N-quinolin-6-ylpiperidine-1-carboxamide Traditional Name: 4-(p-tolyl)-2-(pyrrolidinomethyl)-N-(6-quinolyl)piperidine-1-carboxamide Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(C(C2)CN3CCCC3)C(=O)NC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(C(C2)CN3CCCC3)C(=O)NC4=CC5=C(C=C4)N=CC=C5

InChI

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