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

Systemtic Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate Openeye Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate CAS Name: 4-pentadecylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-octoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate Traditional Name: 4-pentadecylbenzoic acid [4-[4-(1-octoxyethyl)phenyl]phenyl] ester Formula: C44H64O3 MolecularWeight: 640.97716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCCCCCC

InChI

InChI=1S/C44H64O3/c1-4-6-8-10-12-13-14-15-16-17-18-19-21-23-38-24-26-42(27-25-38)44(45)47-43-34-32-41(33-35-43)40-30-28-39(29-31-40)37(3)46-36-22-20-11-9-7-5-2/h24-35,37H,4-23,36H2,1-3H3