2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloranyl-ethenyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloranyl-ethenyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloro-vinyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(Z)-2-(3-butoxy-4-methoxyphenyl)-1-chloroethenyl]-6-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(Z)-2-(3-butoxy-4-methoxyphenyl)-1-chloroethenyl]-6-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(Z)-2-(3-butoxy-4-methoxy-phenyl)-1-chloro-vinyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C(C2=CC(=O)N3C(=CC=CC3=N2)C)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C(/C2=CC(=O)N3C(=CC=CC3=N2)C)\Cl)OC

InChI

InChI=1S/C22H23ClN2O3/c1-4-5-11-28-20-13-16(9-10-19(20)27-3)12-17(23)18-14-22(26)25-15(2)7-6-8-21(25)24-18/h6-10,12-14H,4-5,11H2,1-3H3/b17-12-