1-[(E)-7-ethoxy-7-oxidanylidene-hept-2-enyl]-5-[(E)-4-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)-4-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-4-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-4-methyloct-1-enyl]-2-oxocyclopentane-1,3-dicarboxylic acid IUPAC Name: 1-[(E)-7-ethoxy-7-oxohept-2-enyl]-5-[(E)-3-hydroxy-4-methyloct-1-enyl]-2-oxocyclopentane-1,3-dicarboxylic acid Traditional Name: 1-[(E)-7-ethoxy-7-keto-hept-2-enyl]-5-[(E)-3-hydroxy-4-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38O8/c1-4-6-11-17(3)20(26)14-13-18-16-19(23(29)30)22(28)25(18,24(31)32)15-10-8-7-9-12-21(27)33-5-2/h8,10,13-14,17-20,26H,4-7,9,11-12,15-16H2,1-3H3,(H,29,30)(H,31,32)/b10-8+,14-13+