2-[(3-ethylphenyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(3-ethylphenyl)amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(3-ethylanilino)-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-(3-ethylanilino)-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-(3-ethylanilino)-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(3-ethylanilino)-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H15N4O3+ MolecularWeight: 311.3153

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)NC2=C(C(=O)[N+]3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3/c1-2-11-6-5-7-12(10-11)17-15-14(20(22)23)16(21)19-9-4-3-8-13(19)18-15/h3-10H,2H2,1H3,(H,17,21)/p+1