2-[(Z)-2-(4-butoxyphenyl)-1-chloranyl-ethenyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloranyl-ethenyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloro-vinyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloroethenyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloroethenyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(Z)-2-(4-butoxyphenyl)-1-chloro-vinyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O2/c1-3-4-11-26-17-8-6-16(7-9-17)12-18(22)19-13-21(25)24-14-15(2)5-10-20(24)23-19/h5-10,12-14H,3-4,11H2,1-2H3/b18-12-