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

Systemtic Name: [4-(1-octadecoxyethyl)phenyl] 4-hexoxybenzoate Openeye Name: [4-(1-octadecoxyethyl)phenyl] 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid [4-(1-octadecoxyethyl)phenyl] ester IUPAC Name: [4-(1-octadecoxyethyl)phenyl] 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid [4-(1-stearyloxyethyl)phenyl] ester Formula: C39H62O4 MolecularWeight: 594.90718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H62O4/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-23-32-41-34(3)35-24-30-38(31-25-35)43-39(40)36-26-28-37(29-27-36)42-33-22-9-7-5-2/h24-31,34H,4-23,32-33H2,1-3H3