(4-octoxyphenyl) 4-[4-(2-methylbutyl)phenyl]benzoate

Systemtic Name: (4-octoxyphenyl) 4-[4-(2-methylbutyl)phenyl]benzoate Openeye Name: (4-octoxyphenyl) 4-[4-(2-methylbutyl)phenyl]benzoate CAS Name: 4-[4-(2-methylbutyl)phenyl]benzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 4-[4-(2-methylbutyl)phenyl]benzoate Traditional Name: 4-[4-(2-methylbutyl)phenyl]benzoic acid (4-octoxyphenyl) ester Formula: C32H40O3 MolecularWeight: 472.6582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C32H40O3/c1-4-6-7-8-9-10-23-34-30-19-21-31(22-20-30)35-32(33)29-17-15-28(16-18-29)27-13-11-26(12-14-27)24-25(3)5-2/h11-22,25H,4-10,23-24H2,1-3H3