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

Systemtic Name: 3-nitro-2-[2-(1,2,4-triazol-1-yl)ethylamino]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-nitro-2-[2-(1,2,4-triazol-1-yl)ethylamino]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-nitro-2-[2-(1,2,4-triazol-1-yl)ethylamino]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-nitro-2-[2-(1,2,4-triazol-1-yl)ethylamino]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-nitro-2-[2-(1,2,4-triazol-1-yl)ethylamino]pyrido[1,2-a]pyrimidin-4-one Formula: C12H11N7O3 MolecularWeight: 301.26084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=C(C(=O)N2C=C1)[N+](=O)[O-])NCCN3C=NC=N3

Isomeric SMILES

C1=CC2=NC(=C(C(=O)N2C=C1)[N+](=O)[O-])NCCN3C=NC=N3

InChI

InChI=1S/C12H11N7O3/c20-12-10(19(21)22)11(14-4-6-17-8-13-7-15-17)16-9-3-1-2-5-18(9)12/h1-3,5,7-8,14H,4,6H2