(4-heptylphenyl) 4-[4-(4-methylhexyl)phenyl]benzoate

Systemtic Name: (4-heptylphenyl) 4-[4-(4-methylhexyl)phenyl]benzoate Openeye Name: (4-heptylphenyl) 4-[4-(4-methylhexyl)phenyl]benzoate CAS Name: 4-[4-(4-methylhexyl)phenyl]benzoic acid (4-heptylphenyl) ester IUPAC Name: (4-heptylphenyl) 4-[4-(4-methylhexyl)phenyl]benzoate Traditional Name: 4-[4-(4-methylhexyl)phenyl]benzoic acid (4-heptylphenyl) ester Formula: C33H42O2 MolecularWeight: 470.68538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC(C)CC

InChI

InChI=1S/C33H42O2/c1-4-6-7-8-9-12-27-16-24-32(25-17-27)35-33(34)31-22-20-30(21-23-31)29-18-14-28(15-19-29)13-10-11-26(3)5-2/h14-26H,4-13H2,1-3H3