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

Systemtic Name: 7-chloranyl-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-chloro-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-chloro-2-[[2-(4-methoxyphenyl)-1-azepanyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-chloro-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-chloro-2-[[2-(4-methoxyphenyl)azepan-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC3=CC(=O)N4C=C(C=CC4=N3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2CC3=CC(=O)N4C=C(C=CC4=N3)Cl

InChI

InChI=1S/C22H24ClN3O2/c1-28-19-9-6-16(7-10-19)20-5-3-2-4-12-25(20)15-18-13-22(27)26-14-17(23)8-11-21(26)24-18/h6-11,13-14,20H,2-5,12,15H2,1H3