6-[4-(4-fluorophenyl)piperidin-1-yl]-2-methyl-5-nitro-3-(4-oxidanylbutyl)pyrimidin-4-one

Systemtic Name: 6-[4-(4-fluorophenyl)piperidin-1-yl]-2-methyl-5-nitro-3-(4-oxidanylbutyl)pyrimidin-4-one Openeye Name: 6-[4-(4-fluorophenyl)-1-piperidyl]-3-(4-hydroxybutyl)-2-methyl-5-nitro-pyrimidin-4-one CAS Name: 6-[4-(4-fluorophenyl)-1-piperidinyl]-3-(4-hydroxybutyl)-2-methyl-5-nitro-4-pyrimidinone IUPAC Name: 6-[4-(4-fluorophenyl)piperidin-1-yl]-3-(4-hydroxybutyl)-2-methyl-5-nitropyrimidin-4-one Traditional Name: 6-[4-(4-fluorophenyl)piperidino]-3-(4-hydroxybutyl)-2-methyl-5-nitro-pyrimidin-4-one Formula: C20H25FN4O4 MolecularWeight: 404.435303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1CCCCO)[N+](=O)[O-])N2CCC(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC(=C(C(=O)N1CCCCO)[N+](=O)[O-])N2CCC(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN4O4/c1-14-22-19(18(25(28)29)20(27)24(14)10-2-3-13-26)23-11-8-16(9-12-23)15-4-6-17(21)7-5-15/h4-7,16,26H,2-3,8-13H2,1H3