[4-(4-pentylphenyl)phenyl] 4-hexylbenzoate

Systemtic Name: [4-(4-pentylphenyl)phenyl] 4-hexylbenzoate Openeye Name: [4-(4-pentylphenyl)phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [4-(4-pentylphenyl)phenyl] ester IUPAC Name: [4-(4-pentylphenyl)phenyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [4-(4-amylphenyl)phenyl] ester Formula: C30H36O2 MolecularWeight: 428.60564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

InChI

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