4-butoxy-N-(2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide

Systemtic Name: 4-butoxy-N-(2-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide Openeye Name: 4-butoxy-N-(2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide CAS Name: 4-butoxy-N-(2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide IUPAC Name: 4-butoxy-N-(2-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide Traditional Name: 4-butoxy-N-(4-keto-2-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)benzamide Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(NC3=CC=CC=[N+]3C2=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=C(NC3=CC=CC=[N+]3C2=O)C

InChI

InChI=1S/C20H21N3O3/c1-3-4-13-26-16-10-8-15(9-11-16)19(24)22-18-14(2)21-17-7-5-6-12-23(17)20(18)25/h5-12H,3-4,13H2,1-2H3,(H,22,24)/p+1