[4-(trifluoromethyl)phenyl] 4-[(E)-2-cyanoethenyl]cyclohexane-1-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl] 4-[(E)-2-cyanoethenyl]cyclohexane-1-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl] 4-[(E)-2-cyanovinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-cyanoethenyl]-1-cyclohexanecarboxylic acid [4-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(trifluoromethyl)phenyl] 4-[(E)-2-cyanoethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-cyanovinyl]cyclohexanecarboxylic acid [4-(trifluoromethyl)phenyl] ester Formula: C17H16F3NO2 MolecularWeight: 323.30965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C=CC#N)C(=O)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CC(CCC1/C=C/C#N)C(=O)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H16F3NO2/c18-17(19,20)14-7-9-15(10-8-14)23-16(22)13-5-3-12(4-6-13)2-1-11-21/h1-2,7-10,12-13H,3-6H2/b2-1+