3-nitro-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-nitro-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 3-nitro-2-[4-(3-pyridylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-nitro-2-[4-(3-pyridinylmethyl)-1-piperazinyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-nitro-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 3-nitro-2-[4-(3-pyridylmethyl)piperazino]pyrido[1,2-a]pyrimidin-4-one Formula: C18H18N6O3 MolecularWeight: 366.37392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O3/c25-18-16(24(26)27)17(20-15-5-1-2-7-23(15)18)22-10-8-21(9-11-22)13-14-4-3-6-19-12-14/h1-7,12H,8-11,13H2