(3-fluorophenyl) 4-but-3-enyl-4-cyano-cyclohexane-1-carboxylate

Systemtic Name: (3-fluorophenyl) 4-but-3-enyl-4-cyano-cyclohexane-1-carboxylate Openeye Name: (3-fluorophenyl) 4-but-3-enyl-4-cyano-cyclohexanecarboxylate CAS Name: 4-but-3-enyl-4-cyano-1-cyclohexanecarboxylic acid (3-fluorophenyl) ester IUPAC Name: (3-fluorophenyl) 4-but-3-enyl-4-cyanocyclohexane-1-carboxylate Traditional Name: 4-but-3-enyl-4-cyano-cyclohexanecarboxylic acid (3-fluorophenyl) ester Formula: C18H20FNO2 MolecularWeight: 301.355303

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1(CCC(CC1)C(=O)OC2=CC(=CC=C2)F)C#N

Isomeric SMILES

C=CCCC1(CCC(CC1)C(=O)OC2=CC(=CC=C2)F)C#N

InChI

InChI=1S/C18H20FNO2/c1-2-3-9-18(13-20)10-7-14(8-11-18)17(21)22-16-6-4-5-15(19)12-16/h2,4-6,12,14H,1,3,7-11H2