3-(azepan-1-ylmethyl)-4-(1-benzofuran-2-yl)-6-methyl-2-quinolin-7-yl-benzamide

Systemtic Name: 3-(azepan-1-ylmethyl)-4-(1-benzofuran-2-yl)-6-methyl-2-quinolin-7-yl-benzamide Openeye Name: 3-(azepan-1-ylmethyl)-4-(benzofuran-2-yl)-6-methyl-2-(7-quinolyl)benzamide CAS Name: 3-(1-azepanylmethyl)-4-(2-benzofuranyl)-6-methyl-2-(7-quinolinyl)benzamide IUPAC Name: 3-(azepan-1-ylmethyl)-4-(1-benzofuran-2-yl)-6-methyl-2-quinolin-7-ylbenzamide Traditional Name: 3-(azepan-1-ylmethyl)-4-(benzofuran-2-yl)-6-methyl-2-(7-quinolyl)benzamide Formula: C32H31N3O2 MolecularWeight: 489.60744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C2=CC3=CC=CC=C3O2)CN4CCCCCC4)C5=CC6=C(C=CC=N6)C=C5)C(=O)N

Isomeric SMILES

CC1=C(C(=C(C(=C1)C2=CC3=CC=CC=C3O2)CN4CCCCCC4)C5=CC6=C(C=CC=N6)C=C5)C(=O)N

InChI

InChI=1S/C32H31N3O2/c1-21-17-25(29-19-23-9-4-5-11-28(23)37-29)26(20-35-15-6-2-3-7-16-35)31(30(21)32(33)36)24-13-12-22-10-8-14-34-27(22)18-24/h4-5,8-14,17-19H,2-3,6-7,15-16,20H2,1H3,(H2,33,36)