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

Systemtic Name: 2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(3-nitrophenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C15H12N3O4+ MolecularWeight: 298.27348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC(=CC2=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC(=CC2=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O4/c19-15-8-11(16-14-6-1-2-7-17(14)15)10-22-13-5-3-4-12(9-13)18(20)21/h1-9H,10H2/p+1