N-[3-(azepan-1-ylmethyl)-8-methyl-quinolin-7-yl]-4-(2-oxidanylidenepentyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylmethyl)-8-methyl-quinolin-7-yl]-4-(2-oxidanylidenepentyl)benzamide Openeye Name: N-[3-(azepan-1-ylmethyl)-8-methyl-7-quinolyl]-4-(2-oxopentyl)benzamide CAS Name: N-[3-(1-azepanylmethyl)-8-methyl-7-quinolinyl]-4-(2-oxopentyl)benzamide IUPAC Name: N-[3-(azepan-1-ylmethyl)-8-methylquinolin-7-yl]-4-(2-oxopentyl)benzamide Traditional Name: N-[3-(azepan-1-ylmethyl)-8-methyl-7-quinolyl]-4-(2-ketopentyl)benzamide Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCCCC4)C

Isomeric SMILES

CCCC(=O)CC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCCCC4)C

InChI

InChI=1S/C29H35N3O2/c1-3-8-26(33)18-22-9-11-24(12-10-22)29(34)31-27-14-13-25-17-23(19-30-28(25)21(27)2)20-32-15-6-4-5-7-16-32/h9-14,17,19H,3-8,15-16,18,20H2,1-2H3,(H,31,34)