methyl 3-[1-cyano-3-(4-fluorophenyl)-2-oxidanylidene-propyl]benzoate

Systemtic Name: methyl 3-[1-cyano-3-(4-fluorophenyl)-2-oxidanylidene-propyl]benzoate Openeye Name: methyl 3-[1-cyano-3-(4-fluorophenyl)-2-oxo-propyl]benzoate CAS Name: 3-[1-cyano-3-(4-fluorophenyl)-2-oxopropyl]benzoic acid methyl ester IUPAC Name: methyl 3-[1-cyano-3-(4-fluorophenyl)-2-oxopropyl]benzoate Traditional Name: 3-[1-cyano-3-(4-fluorophenyl)-2-keto-propyl]benzoic acid methyl ester Formula: C18H14FNO3 MolecularWeight: 311.307063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C(C#N)C(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C(C#N)C(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H14FNO3/c1-23-18(22)14-4-2-3-13(10-14)16(11-20)17(21)9-12-5-7-15(19)8-6-12/h2-8,10,16H,9H2,1H3