[4-(4-pentylphenyl)phenyl] 4-(1-octoxyethyl)benzoate

Systemtic Name: [4-(4-pentylphenyl)phenyl] 4-(1-octoxyethyl)benzoate Openeye Name: [4-(4-pentylphenyl)phenyl] 4-(1-octoxyethyl)benzoate CAS Name: 4-(1-octoxyethyl)benzoic acid [4-(4-pentylphenyl)phenyl] ester IUPAC Name: [4-(4-pentylphenyl)phenyl] 4-(1-octoxyethyl)benzoate Traditional Name: 4-(1-octoxyethyl)benzoic acid [4-(4-amylphenyl)phenyl] ester Formula: C34H44O3 MolecularWeight: 500.71136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C34H44O3/c1-4-6-8-9-10-12-26-36-27(3)29-18-20-32(21-19-29)34(35)37-33-24-22-31(23-25-33)30-16-14-28(15-17-30)13-11-7-5-2/h14-25,27H,4-13,26H2,1-3H3