CAS Registry Number®
89331-97-5
CAS Name
4-Cyanophenyl 4-(trans-4-ethylcyclohexyl)benzoate
Molecular Formula
C22H23NO2
Molecular Mass
333.42
Other Names and Identifiers
InChI
InChI=1/C22H23NO2/c1-2-16-3-7-18(8-4-16)19-9-11-20(12-10-19)22(24)25-21-13-5-17(15-23)6-14-21/h5-6,9-14,16,18H,2-4,7-8H2,1H3/t16-,18-
InChIKey
InChIKey=QSXYPHAWOSQCHP-SAABIXHNNA-N
SMILES
C(OC1=CC=C(C#N)C=C1)(=O)C2=CC=C(C=C2)[C@H]3CC[C@H](CC)CC3
Canonical SMILES
N#CC1=CC=C(OC(=O)C2=CC=C(C=C2)C3CCC(CC)CC3)C=C1
Other Names for this Substance
- Benzoic acid, 4-(trans-4-ethylcyclohexyl)-, 4-cyanophenyl ester
- Benzoic acid, 4-(4-ethylcyclohexyl)-, 4-cyanophenyl ester, trans–
- 4-Cyanophenyl 4-(trans-4-ethylcyclohexyl)benzoate
