2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-(4-methoxyphenyl)-1-azepanyl]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CN3CCCCCC3C4=CC=C(C=C4)OC)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CN3CCCCCC3C4=CC=C(C=C4)OC)C=C1

InChI

InChI=1S/C23H27N3O2/c1-17-7-12-22-24-19(14-23(27)26(22)15-17)16-25-13-5-3-4-6-21(25)18-8-10-20(28-2)11-9-18/h7-12,14-15,21H,3-6,13,16H2,1-2H3