3-fluoranyl-4-(4-octoxynonyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 3-fluoranyl-4-(4-octoxynonyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 3-fluoro-4-(4-octoxynonyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 3-fluoro-4-(4-octoxynonyl)-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-fluoro-4-(4-octoxynonyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 3-fluoro-4-(4-octoxynonyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C36H53FO3 MolecularWeight: 552.802623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(CCCCC)CCCC1CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCCCCOC(CCCCC)CCCC1CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C36H53FO3/c1-3-5-7-8-9-14-27-40-33(19-11-6-4-2)20-15-18-31-25-26-36(35(38)39,28-34(31)37)32-23-21-30(22-24-32)29-16-12-10-13-17-29/h10,12-13,16-17,21-24,31,33-34H,3-9,11,14-15,18-20,25-28H2,1-2H3,(H,38,39)