hexyl 2-(4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)ethanoate

Systemtic Name: hexyl 2-(4-oxidanyl-2-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)ethanoate Openeye Name: hexyl 2-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)acetate CAS Name: 2-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)acetic acid hexyl ester IUPAC Name: hexyl 2-(4-hydroxy-2-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)acetate Traditional Name: 2-(4-hydroxy-2-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)acetic acid hexyl ester Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC1=C([N+]2=CC=CC=C2NC1=O)O

Isomeric SMILES

CCCCCCOC(=O)CC1=C([N+]2=CC=CC=C2NC1=O)O

InChI

InChI=1S/C16H20N2O4/c1-2-3-4-7-10-22-14(19)11-12-15(20)17-13-8-5-6-9-18(13)16(12)21/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,20,21)/p+1