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

Systemtic Name: 7-bromanyl-2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-bromo-2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-bromo-2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-bromo-2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-bromo-2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C15H11BrN3O4+ MolecularWeight: 377.16954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H10BrN3O4/c16-10-4-5-14-17-11(6-15(20)18(14)8-10)9-23-13-3-1-2-12(7-13)19(21)22/h1-8H,9H2/p+1