[4-[4-(1-octoxyethyl)phenyl]phenyl] 4-dodecylbenzoate

Systemtic Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Openeye Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-dodecylbenzoate CAS Name: 4-dodecylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Traditional Name: 4-laurylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]phenyl] ester Formula: C41H58O3 MolecularWeight: 598.89742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

InChI

InChI=1S/C41H58O3/c1-4-6-8-10-12-13-14-15-16-18-20-35-21-23-39(24-22-35)41(42)44-40-31-29-38(30-32-40)37-27-25-36(26-28-37)34(3)43-33-19-17-11-9-7-5-2/h21-32,34H,4-20,33H2,1-3H3