[1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate

Systemtic Name: [1-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate Openeye Name: [2-(4-fluorophenyl)-1-methyl-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [1-(4-fluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-fluorophenyl)-1-oxopropan-2-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(4-fluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C16H12FNO5 MolecularWeight: 317.268583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)F)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)F)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H12FNO5/c1-10(15(19)11-6-8-12(17)9-7-11)23-16(20)13-4-2-3-5-14(13)18(21)22/h2-10H,1H3