N-[3-(azepan-1-ylmethyl)-6-methyl-quinolin-7-yl]-4-(4-chlorophenyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylmethyl)-6-methyl-quinolin-7-yl]-4-(4-chlorophenyl)benzamide Openeye Name: N-[3-(azepan-1-ylmethyl)-6-methyl-7-quinolyl]-4-(4-chlorophenyl)benzamide CAS Name: N-[3-(1-azepanylmethyl)-6-methyl-7-quinolinyl]-4-(4-chlorophenyl)benzamide IUPAC Name: N-[3-(azepan-1-ylmethyl)-6-methylquinolin-7-yl]-4-(4-chlorophenyl)benzamide Traditional Name: N-[3-(azepan-1-ylmethyl)-6-methyl-7-quinolyl]-4-(4-chlorophenyl)benzamide Formula: C30H30ClN3O MolecularWeight: 484.0317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CN=C2C=C1NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl)CN5CCCCCC5

Isomeric SMILES

CC1=CC2=CC(=CN=C2C=C1NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl)CN5CCCCCC5

InChI

InChI=1S/C30H30ClN3O/c1-21-16-26-17-22(20-34-14-4-2-3-5-15-34)19-32-29(26)18-28(21)33-30(35)25-8-6-23(7-9-25)24-10-12-27(31)13-11-24/h6-13,16-19H,2-5,14-15,20H2,1H3,(H,33,35)