7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-5-keto-cyclopentyl]enanthic acid Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C)C(C=CC1CCC(=O)C1CCCCCCC(=O)O)O

Isomeric SMILES

CC#CCC(C)C(/C=C/C1CCC(=O)C1CCCCCCC(=O)O)O

InChI

InChI=1S/C21H32O4/c1-3-4-9-16(2)19(22)14-12-17-13-15-20(23)18(17)10-7-5-6-8-11-21(24)25/h12,14,16-19,22H,5-11,13,15H2,1-2H3,(H,24,25)/b14-12+