1-[(E)-7-ethoxy-7-oxidanylidene-hept-2-enyl]-5-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-2-oxidanylidene-cyclopentane-1,3-dicarboxylic acid

Systemtic Name: 1-[(E)-7-ethoxy-7-oxidanylidene-hept-2-enyl]-5-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-2-oxidanylidene-cyclopentane-1,3-dicarboxylic acid Openeye Name: 1-[(E)-7-ethoxy-7-oxo-hept-2-enyl]-5-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-2-oxo-cyclopentane-1,3-dicarboxylic acid CAS Name: 1-[(E)-7-ethoxy-7-oxohept-2-enyl]-5-[(E)-3-hydroxy-3-methyloct-1-enyl]-2-oxocyclopentane-1,3-dicarboxylic acid IUPAC Name: 1-[(E)-7-ethoxy-7-oxohept-2-enyl]-5-[(E)-3-hydroxy-3-methyloct-1-enyl]-2-oxocyclopentane-1,3-dicarboxylic acid Traditional Name: 1-[(E)-7-ethoxy-7-keto-hept-2-enyl]-5-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-2-keto-cyclopentane-1,3-dicarboxylic acid Formula: C25H38O8 MolecularWeight: 466.56442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C=CC1CC(C(=O)C1(CC=CCCCC(=O)OCC)C(=O)O)C(=O)O)O

Isomeric SMILES

CCCCCC(C)(/C=C/C1CC(C(=O)C1(C/C=C/CCCC(=O)OCC)C(=O)O)C(=O)O)O

InChI

InChI=1S/C25H38O8/c1-4-6-10-14-24(3,32)16-13-18-17-19(22(28)29)21(27)25(18,23(30)31)15-11-8-7-9-12-20(26)33-5-2/h8,11,13,16,18-19,32H,4-7,9-10,12,14-15,17H2,1-3H3,(H,28,29)(H,30,31)/b11-8+,16-13+