[4-(4-hexylphenyl)phenyl] 4-pentylbenzoate

Systemtic Name: [4-(4-hexylphenyl)phenyl] 4-pentylbenzoate Openeye Name: [4-(4-hexylphenyl)phenyl] 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid [4-(4-hexylphenyl)phenyl] ester IUPAC Name: [4-(4-hexylphenyl)phenyl] 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid [4-(4-hexylphenyl)phenyl] ester Formula: C30H36O2 MolecularWeight: 428.60564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C30H36O2/c1-3-5-7-9-11-25-12-16-26(17-13-25)27-20-22-29(23-21-27)32-30(31)28-18-14-24(15-19-28)10-8-6-4-2/h12-23H,3-11H2,1-2H3