3-fluoranyl-4-octoxy-4-octyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 3-fluoranyl-4-octoxy-4-octyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 3-fluoro-4-octoxy-4-octyl-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 3-fluoro-4-octoxy-4-octyl-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-fluoro-4-octoxy-4-octyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 3-fluoro-4-octoxy-4-octyl-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C35H51FO3 MolecularWeight: 538.776043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1(CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)OCCCCCCCC

InChI

InChI=1S/C35H51FO3/c1-3-5-7-9-11-16-24-35(39-27-17-12-10-8-6-4-2)26-25-34(33(37)38,28-32(35)36)31-22-20-30(21-23-31)29-18-14-13-15-19-29/h13-15,18-23,32H,3-12,16-17,24-28H2,1-2H3,(H,37,38)