methyl (E)-7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)hept-4-enoate

Systemtic Name: methyl (E)-7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)hept-4-enoate Openeye Name: methyl (E)-7-(3-hydroxy-5-oxo-cyclopenten-1-yl)hept-4-enoate CAS Name: (E)-7-(3-hydroxy-5-oxo-1-cyclopentenyl)-4-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-4-enoate Traditional Name: (E)-7-(3-hydroxy-5-keto-cyclopenten-1-yl)hept-4-enoic acid methyl ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC=CCCC1=CC(CC1=O)O

Isomeric SMILES

COC(=O)CC/C=C/CCC1=CC(CC1=O)O

InChI

InChI=1S/C13H18O4/c1-17-13(16)7-5-3-2-4-6-10-8-11(14)9-12(10)15/h2-3,8,11,14H,4-7,9H2,1H3/b3-2+