3-fluoranyl-4-heptoxy-4-hexyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 3-fluoranyl-4-heptoxy-4-hexyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 3-fluoro-4-heptoxy-4-hexyl-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 3-fluoro-4-heptoxy-4-hexyl-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-fluoro-4-heptoxy-4-hexyl-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 3-fluoro-4-heptoxy-4-hexyl-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C32H45FO3 MolecularWeight: 496.696303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1(CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)CCCCCC

Isomeric SMILES

CCCCCCCOC1(CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)CCCCCC

InChI

InChI=1S/C32H45FO3/c1-3-5-7-9-14-24-36-32(21-13-8-6-4-2)23-22-31(30(34)35,25-29(32)33)28-19-17-27(18-20-28)26-15-11-10-12-16-26/h10-12,15-20,29H,3-9,13-14,21-25H2,1-2H3,(H,34,35)