[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-nitrobenzoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 4-nitrobenzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C17H14FNO5 MolecularWeight: 331.295163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14FNO5/c18-14-7-3-12(4-8-14)16(20)2-1-11-24-17(21)13-5-9-15(10-6-13)19(22)23/h3-10H,1-2,11H2