(4-bromophenyl)methyl-methyl-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Traditional Name: (4-bromobenzyl)-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-methyl-ammonium Formula: C17H18BrN3O+2 MolecularWeight: 360.24832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC2=CC(=O)[N+]3=CC=CC=C3N2

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC2=CC(=O)[N+]3=CC=CC=C3N2

InChI

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