(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]-methyl-ammonium CAS Name: (7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-methylazanium Traditional Name: benzyl-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C17H17BrN3O+ MolecularWeight: 359.24038

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C17H16BrN3O/c1-20(10-13-5-3-2-4-6-13)12-15-9-17(22)21-11-14(18)7-8-16(21)19-15/h2-9,11H,10,12H2,1H3/p+1