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

Systemtic Name: 2-methylbutyl 2-[4-(4-octoxyphenyl)phenyl]carbonyloxybenzoate Openeye Name: 2-methylbutyl 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoate CAS Name: 2-[[4-(4-octoxyphenyl)phenyl]-oxomethoxy]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoate Traditional Name: 2-[4-(4-octoxyphenyl)benzoyl]oxybenzoic acid 2-methylbutyl 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=CC=C3C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OCC(C)CC

InChI

InChI=1S/C33H40O5/c1-4-6-7-8-9-12-23-36-29-21-19-27(20-22-29)26-15-17-28(18-16-26)32(34)38-31-14-11-10-13-30(31)33(35)37-24-25(3)5-2/h10-11,13-22,25H,4-9,12,23-24H2,1-3H3