(2-octoxyphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate

Systemtic Name: (2-octoxyphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Openeye Name: (2-octoxyphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate CAS Name: 4-[4-(1-dodecoxyethyl)phenyl]benzoic acid (2-octoxyphenyl) ester IUPAC Name: (2-octoxyphenyl) 4-[4-(1-dodecoxyethyl)phenyl]benzoate Traditional Name: 4-[4-(1-lauryloxyethyl)phenyl]benzoic acid (2-octoxyphenyl) ester Formula: C41H58O4 MolecularWeight: 614.89682

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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=C3OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3OCCCCCCCC

InChI

InChI=1S/C41H58O4/c1-4-6-8-10-12-13-14-15-17-20-32-43-34(3)35-24-26-36(27-25-35)37-28-30-38(31-29-37)41(42)45-40-23-19-18-22-39(40)44-33-21-16-11-9-7-5-2/h18-19,22-31,34H,4-17,20-21,32-33H2,1-3H3