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

Systemtic Name: [4-(1-octadecoxyethyl)phenyl] 4-hexylbenzoate Openeye Name: [4-(1-octadecoxyethyl)phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [4-(1-octadecoxyethyl)phenyl] ester IUPAC Name: [4-(1-octadecoxyethyl)phenyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [4-(1-stearyloxyethyl)phenyl] ester Formula: C39H62O3 MolecularWeight: 578.90778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCCC

InChI

InChI=1S/C39H62O3/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-23-33-41-34(3)36-29-31-38(32-30-36)42-39(40)37-27-25-35(26-28-37)24-22-9-7-5-2/h25-32,34H,4-24,33H2,1-3H3