(E)-7-[3-bromanyl-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-5-oxidanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[3-bromanyl-2-[(E)-4,4-dimethyl-3-oxidanyl-oct-1-enyl]-5-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-bromo-5-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-bromo-5-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-bromo-5-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-bromo-5-hydroxy-2-[(E)-3-hydroxy-4,4-dimethyl-oct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C22H37BrO4 MolecularWeight: 445.43078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C=CC1C(CC(C1CC=CCCCC(=O)O)O)Br)O

Isomeric SMILES

CCCCC(C)(C)C(/C=C/C1C(CC(C1C/C=C/CCCC(=O)O)O)Br)O

InChI

InChI=1S/C22H37BrO4/c1-4-5-14-22(2,3)20(25)13-12-16-17(19(24)15-18(16)23)10-8-6-7-9-11-21(26)27/h6,8,12-13,16-20,24-25H,4-5,7,9-11,14-15H2,1-3H3,(H,26,27)/b8-6+,13-12+