3-nitro-2-[2-[(4-nitrophenyl)amino]ethylamino]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-nitro-2-[2-[(4-nitrophenyl)amino]ethylamino]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-nitro-2-[2-(4-nitroanilino)ethylamino]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-nitro-2-[2-(4-nitroanilino)ethylamino]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-nitro-2-[2-(4-nitroanilino)ethylamino]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-nitro-2-[2-(4-nitroanilino)ethylamino]pyrido[1,2-a]pyrimidin-4-one Formula: C16H14N6O5 MolecularWeight: 370.31956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=C(C(=O)N2C=C1)[N+](=O)[O-])NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NC(=C(C(=O)N2C=C1)[N+](=O)[O-])NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O5/c23-16-14(22(26)27)15(19-13-3-1-2-10-20(13)16)18-9-8-17-11-4-6-12(7-5-11)21(24)25/h1-7,10,17-18H,8-9H2