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

Systemtic Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-chlorophenyl)benzamide Openeye Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(4-chlorophenyl)benzamide CAS Name: N-[3-(1-azepanylmethyl)-7-quinolinyl]-4-(4-chlorophenyl)benzamide IUPAC Name: N-[3-(azepan-1-ylmethyl)quinolin-7-yl]-4-(4-chlorophenyl)benzamide Traditional Name: N-[3-(azepan-1-ylmethyl)-7-quinolyl]-4-(4-chlorophenyl)benzamide Formula: C29H28ClN3O MolecularWeight: 470.00512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCCN(CC1)CC2=CN=C3C=C(C=CC3=C2)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H28ClN3O/c30-26-12-9-23(10-13-26)22-5-7-24(8-6-22)29(34)32-27-14-11-25-17-21(19-31-28(25)18-27)20-33-15-3-1-2-4-16-33/h5-14,17-19H,1-4,15-16,20H2,(H,32,34)