2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoranylpent-1-enyl]benzoic acid

Systemtic Name: 2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoranylpent-1-enyl]benzoic acid Openeye Name: 2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoropent-1-enyl]benzoic acid CAS Name: 2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoropent-1-enyl]benzoic acid IUPAC Name: 2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoropent-1-enyl]benzoic acid Traditional Name: 2-[4-(4-butylcyclohexyl)phenyl]-4-[(E)-2-fluoropent-1-enyl]benzoic acid Formula: C28H35FO2 MolecularWeight: 422.574703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C=CC(=C3)C=C(CCC)F)C(=O)O

Isomeric SMILES

CCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C=CC(=C3)/C=C(\CCC)/F)C(=O)O

InChI

InChI=1S/C28H35FO2/c1-3-5-7-20-8-11-22(12-9-20)23-13-15-24(16-14-23)27-19-21(18-25(29)6-4-2)10-17-26(27)28(30)31/h10,13-20,22H,3-9,11-12H2,1-2H3,(H,30,31)/b25-18+