[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4,5-dimethoxy-2-nitro-benzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C19H18FNO7 MolecularWeight: 391.347123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18FNO7/c1-26-17-10-14(15(21(24)25)11-18(17)27-2)19(23)28-9-3-4-16(22)12-5-7-13(20)8-6-12/h5-8,10-11H,3-4,9H2,1-2H3