(E)-7-[2-[(E)-3-cyclohexyl-3-oxidanyl-prop-1-enyl]-5-oxidanylidene-cyclopentyl]hept-4-enoic acid

Systemtic Name: (E)-7-[2-[(E)-3-cyclohexyl-3-oxidanyl-prop-1-enyl]-5-oxidanylidene-cyclopentyl]hept-4-enoic acid Openeye Name: (E)-7-[2-[(E)-3-cyclohexyl-3-hydroxy-prop-1-enyl]-5-oxo-cyclopentyl]hept-4-enoic acid CAS Name: (E)-7-[2-[(E)-3-cyclohexyl-3-hydroxyprop-1-enyl]-5-oxocyclopentyl]-4-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-3-cyclohexyl-3-hydroxyprop-1-enyl]-5-oxocyclopentyl]hept-4-enoic acid Traditional Name: (E)-7-[2-[(E)-3-cyclohexyl-3-hydroxy-prop-1-enyl]-5-keto-cyclopentyl]hept-4-enoic acid Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C=CC2CCC(=O)C2CCC=CCCC(=O)O)O

Isomeric SMILES

C1CCC(CC1)C(/C=C/C2CCC(=O)C2CC/C=C/CCC(=O)O)O

InChI

InChI=1S/C21H32O4/c22-19(17-8-4-3-5-9-17)14-12-16-13-15-20(23)18(16)10-6-1-2-7-11-21(24)25/h1-2,12,14,16-19,22H,3-11,13,15H2,(H,24,25)/b2-1+,14-12+