[2-oxidanylidene-2-[4-(4-pentylphenyl)phenyl]ethyl] 4-heptylbenzoate

Systemtic Name: [2-oxidanylidene-2-[4-(4-pentylphenyl)phenyl]ethyl] 4-heptylbenzoate Openeye Name: [2-oxo-2-[4-(4-pentylphenyl)phenyl]ethyl] 4-heptylbenzoate CAS Name: 4-heptylbenzoic acid [2-oxo-2-[4-(4-pentylphenyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(4-pentylphenyl)phenyl]ethyl] 4-heptylbenzoate Traditional Name: 4-heptylbenzoic acid [2-[4-(4-amylphenyl)phenyl]-2-keto-ethyl] ester Formula: C33H40O3 MolecularWeight: 484.6689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C33H40O3/c1-3-5-7-8-10-12-27-15-19-31(20-16-27)33(35)36-25-32(34)30-23-21-29(22-24-30)28-17-13-26(14-18-28)11-9-6-4-2/h13-24H,3-12,25H2,1-2H3