1-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-2-oxo-ethyl]-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[2-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-2-keto-ethyl]-2-keto-5-nitro-nicotinonitrile Formula: C20H18FN5O5 MolecularWeight: 427.385823

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])F

InChI

InChI=1S/C20H18FN5O5/c1-13(27)14-2-3-18(17(21)9-14)23-4-6-24(7-5-23)19(28)12-25-11-16(26(30)31)8-15(10-22)20(25)29/h2-3,8-9,11H,4-7,12H2,1H3