4-[2,3-bis(fluoranyl)-4-propyl-undecyl]-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 4-[2,3-bis(fluoranyl)-4-propyl-undecyl]-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Openeye Name: 4-(2,3-difluoro-4-propyl-undecyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid CAS Name: 4-(2,3-difluoro-4-propylundecyl)-1-(4-phenylphenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-(2,3-difluoro-4-propylundecyl)-1-(4-phenylphenyl)cyclohexane-1-carboxylic acid Traditional Name: 4-(2,3-difluoro-4-propyl-undecyl)-1-(4-phenylphenyl)cyclohexanecarboxylic acid Formula: C33H46F2O2 MolecularWeight: 512.713946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCC)C(C(CC1CCC(CC1)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)F)F

Isomeric SMILES

CCCCCCCC(CCC)C(C(CC1CCC(CC1)(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)F)F

InChI

InChI=1S/C33H46F2O2/c1-3-5-6-7-9-15-28(12-4-2)31(35)30(34)24-25-20-22-33(23-21-25,32(36)37)29-18-16-27(17-19-29)26-13-10-8-11-14-26/h8,10-11,13-14,16-19,25,28,30-31H,3-7,9,12,15,20-24H2,1-2H3,(H,36,37)