2-[4-[(E)-2-fluoranyloct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate

Systemtic Name: 2-[4-[(E)-2-fluoranyloct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate Openeye Name: 2-[4-[(E)-2-fluorooct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate CAS Name: 2-[4-[(E)-2-fluorooct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate IUPAC Name: 2-[4-[(E)-2-fluorooct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate Traditional Name: 2-[4-[(E)-2-fluorooct-1-enyl]phenyl]-4-(4-propylcyclohexyl)benzoate Formula: C30H38FO2- MolecularWeight: 449.619923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CC1=CC=C(C=C1)C2=C(C=CC(=C2)C3CCC(CC3)CCC)C(=O)[O-])F

Isomeric SMILES

CCCCCC/C(=C\C1=CC=C(C=C1)C2=C(C=CC(=C2)C3CCC(CC3)CCC)C(=O)[O-])/F

InChI

InChI=1S/C30H39FO2/c1-3-5-6-7-9-27(31)20-23-12-16-25(17-13-23)29-21-26(18-19-28(29)30(32)33)24-14-10-22(8-4-2)11-15-24/h12-13,16-22,24H,3-11,14-15H2,1-2H3,(H,32,33)/p-1/b27-20+