[4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexyl] 4-ethylbenzoate

Systemtic Name: [4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexyl] 4-ethylbenzoate Openeye Name: [4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [4-[(E)-2-cyano-2-fluoroethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyano-2-fluoroethenyl]cyclohexyl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexyl] ester Formula: C18H20FNO2 MolecularWeight: 301.355303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC2CCC(CC2)C=C(C#N)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OC2CCC(CC2)/C=C(\C#N)/F

InChI

InChI=1S/C18H20FNO2/c1-2-13-3-7-15(8-4-13)18(21)22-17-9-5-14(6-10-17)11-16(19)12-20/h3-4,7-8,11,14,17H,2,5-6,9-10H2,1H3/b16-11+