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

Systemtic Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-chlorophenyl)piperidine-1-carboxamide Openeye Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(4-chlorophenyl)piperidine-1-carboxamide CAS Name: N-[3-(1-azepanylmethyl)-7-quinolinyl]-4-(4-chlorophenyl)-1-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-chlorophenyl)piperidine-1-carboxamide Traditional Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(4-chlorophenyl)piperidine-1-carboxamide Formula: C28H33ClN4O MolecularWeight: 477.04082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)N4CCC(CC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCCN(CC1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)N4CCC(CC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H33ClN4O/c29-25-8-5-22(6-9-25)23-11-15-33(16-12-23)28(34)31-26-10-7-24-17-21(19-30-27(24)18-26)20-32-13-3-1-2-4-14-32/h5-10,17-19,23H,1-4,11-16,20H2,(H,31,34)