6-[4-(4-fluorophenyl)piperidin-1-yl]-2-methyl-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[4-(4-fluorophenyl)piperidin-1-yl]-2-methyl-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[4-(4-fluorophenyl)-1-piperidyl]-2-methyl-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[4-(4-fluorophenyl)-1-piperidinyl]-2-methyl-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-[4-(4-fluorophenyl)piperidin-1-yl]-2-methyl-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[4-(4-fluorophenyl)piperidino]-2-methyl-5-nitro-1H-pyrimidin-4-one Formula: C16H17FN4O3 MolecularWeight: 332.329583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)N2CCC(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C(=C(N1)N2CCC(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H17FN4O3/c1-10-18-15(14(21(23)24)16(22)19-10)20-8-6-12(7-9-20)11-2-4-13(17)5-3-11/h2-5,12H,6-9H2,1H3,(H,18,19,22)