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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(CC)CCCC1CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCCCOC(CC)CCCC1CCC(CC1F)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C32H45FO3/c1-3-5-6-7-11-23-36-29(4-2)16-12-15-27-21-22-32(31(34)35,24-30(27)33)28-19-17-26(18-20-28)25-13-9-8-10-14-25/h8-10,13-14,17-20,27,29-30H,3-7,11-12,15-16,21-24H2,1-2H3,(H,34,35)