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

Systemtic Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Openeye Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate CAS Name: 4-dodecylbenzoic acid [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-dodecylbenzoate Traditional Name: 4-laurylbenzoic acid [4-[4-(1-cetyloxyethyl)phenyl]phenyl] ester Formula: C49H74O3 MolecularWeight: 711.11006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCCCCCCC

InChI

InChI=1S/C49H74O3/c1-4-6-8-10-12-14-16-17-18-19-21-23-25-27-41-51-42(3)44-33-35-45(36-34-44)46-37-39-48(40-38-46)52-49(50)47-31-29-43(30-32-47)28-26-24-22-20-15-13-11-9-7-5-2/h29-40,42H,4-28,41H2,1-3H3