methyl 3-bromanyl-4-[(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoate Openeye Name: methyl 3-bromo-4-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoate CAS Name: 3-bromo-4-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoate Traditional Name: 3-bromo-4-[(4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methoxy]benzoic acid methyl ester Formula: C18H16BrN2O4+ MolecularWeight: 404.23464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=C(C=C(C=C3)C(=O)OC)Br

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=C(C=C(C=C3)C(=O)OC)Br

InChI

InChI=1S/C18H15BrN2O4/c1-11-4-3-7-21-16(22)9-13(20-17(11)21)10-25-15-6-5-12(8-14(15)19)18(23)24-2/h3-9H,10H2,1-2H3/p+1