propyl 3-cyano-3-fluoranyl-2-(3-methylphenyl)-6-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: propyl 3-cyano-3-fluoranyl-2-(3-methylphenyl)-6-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: propyl 3-cyano-3-fluoro-2-(m-tolyl)-6-oxo-cyclohexanecarboxylate CAS Name: 3-cyano-3-fluoro-2-(3-methylphenyl)-6-oxo-1-cyclohexanecarboxylic acid propyl ester IUPAC Name: propyl 3-cyano-3-fluoro-2-(3-methylphenyl)-6-oxocyclohexane-1-carboxylate Traditional Name: 3-cyano-3-fluoro-6-keto-2-(m-tolyl)cyclohexanecarboxylic acid propyl ester Formula: C18H20FNO3 MolecularWeight: 317.354703

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(C(CCC1=O)(C#N)F)C2=CC(=CC=C2)C

Isomeric SMILES

CCCOC(=O)C1C(C(CCC1=O)(C#N)F)C2=CC(=CC=C2)C

InChI

InChI=1S/C18H20FNO3/c1-3-9-23-17(22)15-14(21)7-8-18(19,11-20)16(15)13-6-4-5-12(2)10-13/h4-6,10,15-16H,3,7-9H2,1-2H3