(2-hexan-3-ylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate

Systemtic Name: (2-hexan-3-ylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Openeye Name: [2-(1-ethylbutyl)phenyl] 4-[4-(1-dodecoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid (2-hexan-3-ylphenyl) ester IUPAC Name: (2-hexan-3-ylphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-lauryloxyethyl)phenyl]benzoic acid [2-(1-ethylbutyl)phenyl] ester Formula: C39H54O3 MolecularWeight: 570.84426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CC)CCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(CC)CCC

InChI

InChI=1S/C39H54O3/c1-5-8-9-10-11-12-13-14-15-18-30-41-31(4)33-22-24-34(25-23-33)35-26-28-36(29-27-35)39(40)42-38-21-17-16-20-37(38)32(7-3)19-6-2/h16-17,20-29,31-32H,5-15,18-19,30H2,1-4H3