7-methyl-2-[[4-(3-oxidanylidenebutyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-methyl-2-[[4-(3-oxidanylidenebutyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-methyl-2-[[4-(3-oxobutyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-methyl-2-[[4-(3-oxobutyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-methyl-2-[[4-(3-oxobutyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-(3-ketobutyl)phenoxy]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=CC=C(C=C3)CCC(=O)C

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=CC=C(C=C3)CCC(=O)C

InChI

InChI=1S/C20H20N2O3/c1-14-3-10-19-21-17(11-20(24)22(19)12-14)13-25-18-8-6-16(7-9-18)5-4-15(2)23/h3,6-12H,4-5,13H2,1-2H3/p+1