[4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-hexylbenzoate

Systemtic Name: [4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-hexylbenzoate Openeye Name: [4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [4-[4-(1-hexoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-hexoxyethyl)phenyl]phenyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [4-[4-(1-hexoxyethyl)phenyl]phenyl] ester Formula: C33H42O3 MolecularWeight: 486.68478

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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)C(C)OCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C33H42O3/c1-4-6-8-10-12-27-13-15-31(16-14-27)33(34)36-32-23-21-30(22-24-32)29-19-17-28(18-20-29)26(3)35-25-11-9-7-5-2/h13-24,26H,4-12,25H2,1-3H3