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

Systemtic Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)piperidine-1-carboxamide Openeye Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(p-tolyl)piperidine-1-carboxamide CAS Name: N-[3-(1-azepanylmethyl)-7-quinolinyl]-4-(4-methylphenyl)-1-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-methylphenyl)piperidine-1-carboxamide Traditional Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(p-tolyl)piperidine-1-carboxamide Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(CC2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(CC2)C(=O)NC3=CC4=NC=C(C=C4C=C3)CN5CCCCCC5

InChI

InChI=1S/C29H36N4O/c1-22-6-8-24(9-7-22)25-12-16-33(17-13-25)29(34)31-27-11-10-26-18-23(20-30-28(26)19-27)21-32-14-4-2-3-5-15-32/h6-11,18-20,25H,2-5,12-17,21H2,1H3,(H,31,34)