4,4-dimethyl-7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: 4,4-dimethyl-7-[2-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-oxo-cyclopentyl]-4,4-dimethyl-heptanoate CAS Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]-4,4-dimethylheptanoate IUPAC Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]-4,4-dimethylheptanoate Traditional Name: 7-[3-hydroxy-2-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-5-keto-cyclopentyl]-4,4-dimethyl-enanthate Formula: C23H39O5- MolecularWeight: 395.55276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CCCC(C)(C)CCC(=O)[O-])O)O

Isomeric SMILES

CCCCC(C)(C/C=C/C1C(CC(=O)C1CCCC(C)(C)CCC(=O)[O-])O)O

InChI

InChI=1S/C23H40O5/c1-5-6-13-23(4,28)14-8-10-18-17(19(24)16-20(18)25)9-7-12-22(2,3)15-11-21(26)27/h8,10,17-18,20,25,28H,5-7,9,11-16H2,1-4H3,(H,26,27)/p-1/b10-8+