(2-cyano-4-fluoranyl-phenyl) 4-butylcyclohexane-1-carboxylate

Systemtic Name: (2-cyano-4-fluoranyl-phenyl) 4-butylcyclohexane-1-carboxylate Openeye Name: (2-cyano-4-fluoro-phenyl) 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid (2-cyano-4-fluorophenyl) ester IUPAC Name: (2-cyano-4-fluorophenyl) 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid (2-cyano-4-fluoro-phenyl) ester Formula: C18H22FNO2 MolecularWeight: 303.371183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OC2=C(C=C(C=C2)F)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OC2=C(C=C(C=C2)F)C#N

InChI

InChI=1S/C18H22FNO2/c1-2-3-4-13-5-7-14(8-6-13)18(21)22-17-10-9-16(19)11-15(17)12-20/h9-11,13-14H,2-8H2,1H3