ethyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate

Systemtic Name: ethyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate Openeye Name: ethyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate CAS Name: 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate Traditional Name: 4-[4-[4-(4-amylcyclohexyl)phenyl]phenyl]butyric acid ethyl ester Formula: C29H40O2 MolecularWeight: 420.6267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC(=O)OCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC(=O)OCC

InChI

InChI=1S/C29H40O2/c1-3-5-6-8-23-11-15-25(16-12-23)27-19-21-28(22-20-27)26-17-13-24(14-18-26)9-7-10-29(30)31-4-2/h13-14,17-23,25H,3-12,15-16H2,1-2H3