4-[[methyl-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzamide

Systemtic Name: 4-[[methyl-(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzamide Openeye Name: 4-[[methyl-(3-nitro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzamide CAS Name: 4-[[methyl-(3-nitro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)amino]methyl]benzamide IUPAC Name: 4-[[methyl-(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzamide Traditional Name: 4-[[(4-keto-3-nitro-pyrido[1,2-a]pyrimidin-2-yl)-methyl-amino]methyl]benzamide Formula: C17H15N5O4 MolecularWeight: 353.3321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)N)C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)N)C2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O4/c1-20(10-11-5-7-12(8-6-11)15(18)23)16-14(22(25)26)17(24)21-9-3-2-4-13(21)19-16/h2-9H,10H2,1H3,(H2,18,23)