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

Systemtic Name: 4-ethyl-3-fluoranyl-4-heptoxy-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 4-ethyl-3-fluoro-4-heptoxy-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 4-ethyl-3-fluoro-4-heptoxy-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-ethyl-3-fluoro-4-heptoxy-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 4-ethyl-3-fluoro-4-heptoxy-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C28H37FO3 MolecularWeight: 440.589983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37FO3/c1-3-5-6-7-11-20-32-28(4-2)19-18-27(26(30)31,21-25(28)29)24-16-14-23(15-17-24)22-12-9-8-10-13-22/h8-10,12-17,25H,3-7,11,18-21H2,1-2H3,(H,30,31)