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

Systemtic Name: methyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate Openeye Name: methyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate CAS Name: 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]butanoate Traditional Name: 4-[4-[4-(4-amylcyclohexyl)phenyl]phenyl]butyric acid methyl ester Formula: C28H38O2 MolecularWeight: 406.60012

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)OC

Isomeric SMILES

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

InChI

InChI=1S/C28H38O2/c1-3-4-5-7-22-10-14-24(15-11-22)26-18-20-27(21-19-26)25-16-12-23(13-17-25)8-6-9-28(29)30-2/h12-13,16-22,24H,3-11,14-15H2,1-2H3