N-(2-bromanyl-4-methyl-phenyl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C16H13BrN3O2+ MolecularWeight: 359.19732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CNC3=CC=CC=[N+]3C2=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CNC3=CC=CC=[N+]3C2=O)Br

InChI

InChI=1S/C16H12BrN3O2/c1-10-5-6-13(12(17)8-10)19-15(21)11-9-18-14-4-2-3-7-20(14)16(11)22/h2-9H,1H3,(H,19,21)/p+1