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

Systemtic Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-(4-octoxyphenyl)benzoate Openeye Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid [4-[2-methylbutoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylbutoxycarbonyl)phenyl] 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid [4-(2-methylbutoxycarbonyl)phenyl] ester Formula: C33H40O5 MolecularWeight: 516.6677

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCC(C)CC

InChI

InChI=1S/C33H40O5/c1-4-6-7-8-9-10-23-36-30-19-15-27(16-20-30)26-11-13-29(14-12-26)33(35)38-31-21-17-28(18-22-31)32(34)37-24-25(3)5-2/h11-22,25H,4-10,23-24H2,1-3H3