4-[(Z)-1-fluoranylhept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate

Systemtic Name: 4-[(Z)-1-fluoranylhept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate Openeye Name: 4-[(Z)-1-fluorohept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate CAS Name: 4-[(Z)-1-fluorohept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate IUPAC Name: 4-[(Z)-1-fluorohept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate Traditional Name: 4-[(Z)-1-fluorohept-1-enyl]-2-[4-(4-propylcyclohexyl)phenyl]benzoate Formula: C29H36FO2- MolecularWeight: 435.593343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37FO2/c1-3-5-6-7-9-28(30)25-18-19-26(29(31)32)27(20-25)24-16-14-23(15-17-24)22-12-10-21(8-4-2)11-13-22/h9,14-22H,3-8,10-13H2,1-2H3,(H,31,32)/p-1/b28-9-