2-[4-(4-octoxycarbonyloxyphenyl)phenyl]-3-(trifluoromethyl)heptanoic acid

Systemtic Name: 2-[4-(4-octoxycarbonyloxyphenyl)phenyl]-3-(trifluoromethyl)heptanoic acid Openeye Name: 2-[4-(4-octoxycarbonyloxyphenyl)phenyl]-3-(trifluoromethyl)heptanoic acid CAS Name: 2-[4-[4-[octoxy(oxo)methoxy]phenyl]phenyl]-3-(trifluoromethyl)heptanoic acid IUPAC Name: 2-[4-(4-octoxycarbonyloxyphenyl)phenyl]-3-(trifluoromethyl)heptanoic acid Traditional Name: 2-[4-(4-octoxycarbonyloxyphenyl)phenyl]-3-(trifluoromethyl)enanthic acid Formula: C29H37F3O5 MolecularWeight: 522.59629

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(C(CCCC)C(F)(F)F)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(C(CCCC)C(F)(F)F)C(=O)O

InChI

InChI=1S/C29H37F3O5/c1-3-5-7-8-9-10-20-36-28(35)37-24-18-16-22(17-19-24)21-12-14-23(15-13-21)26(27(33)34)25(11-6-4-2)29(30,31)32/h12-19,25-26H,3-11,20H2,1-2H3,(H,33,34)