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

Systemtic Name: 2-[[(3-bromanyl-4-methyl-phenyl)amino]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(3-bromo-4-methyl-anilino)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(3-bromo-4-methylanilino)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(3-bromo-4-methylanilino)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(3-bromo-4-methyl-anilino)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H17BrN3O+ MolecularWeight: 359.24038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CNC3=CC(=C(C=C3)C)Br

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CNC3=CC(=C(C=C3)C)Br

InChI

InChI=1S/C17H16BrN3O/c1-11-3-6-16-20-14(8-17(22)21(16)10-11)9-19-13-5-4-12(2)15(18)7-13/h3-8,10,19H,9H2,1-2H3/p+1