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

Systemtic Name: 3-fluoranyl-4-(4-heptoxypentyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 3-fluoro-4-(4-heptoxypentyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 3-fluoro-4-(4-heptoxypentyl)-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-fluoro-4-(4-heptoxypentyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 3-fluoro-4-(4-heptoxypentyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C31H43FO3 MolecularWeight: 482.669723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H43FO3/c1-3-4-5-6-10-22-35-24(2)12-11-15-27-20-21-31(30(33)34,23-29(27)32)28-18-16-26(17-19-28)25-13-8-7-9-14-25/h7-9,13-14,16-19,24,27,29H,3-6,10-12,15,20-23H2,1-2H3,(H,33,34)