3-[(E)-4-(1-fluoranylethenyl)-4-oxidanyl-oct-1-enyl]-2-heptyl-4-oxidanyl-cyclopentan-1-one

Systemtic Name: 3-[(E)-4-(1-fluoranylethenyl)-4-oxidanyl-oct-1-enyl]-2-heptyl-4-oxidanyl-cyclopentan-1-one Openeye Name: 3-[(E)-4-(1-fluorovinyl)-4-hydroxy-oct-1-enyl]-2-heptyl-4-hydroxy-cyclopentanone CAS Name: 3-[(E)-4-(1-fluoroethenyl)-4-hydroxyoct-1-enyl]-2-heptyl-4-hydroxy-1-cyclopentanone IUPAC Name: 3-[(E)-4-(1-fluoroethenyl)-4-hydroxyoct-1-enyl]-2-heptyl-4-hydroxycyclopentan-1-one Traditional Name: 3-[(1E)-4-butyl-5-fluoro-4-hydroxy-hexa-1,5-dienyl]-2-heptyl-4-hydroxy-cyclopentanone Formula: C22H37FO3 MolecularWeight: 368.525783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(C(CC1=O)O)C=CCC(CCCC)(C(=C)F)O

Isomeric SMILES

CCCCCCCC1C(C(CC1=O)O)/C=C/CC(CCCC)(C(=C)F)O

InChI

InChI=1S/C22H37FO3/c1-4-6-8-9-10-12-18-19(21(25)16-20(18)24)13-11-15-22(26,17(3)23)14-7-5-2/h11,13,18-19,21,25-26H,3-10,12,14-16H2,1-2H3/b13-11+