methyl 7-(2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)hept-4-ynoate

Systemtic Name: methyl 7-(2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)hept-4-ynoate Openeye Name: methyl 7-(2-hydroxy-5-oxo-cyclopent-3-en-1-yl)hept-4-ynoate CAS Name: 7-(2-hydroxy-5-oxo-1-cyclopent-3-enyl)-4-heptynoic acid methyl ester IUPAC Name: methyl 7-(2-hydroxy-5-oxocyclopent-3-en-1-yl)hept-4-ynoate Traditional Name: 7-(2-hydroxy-5-keto-cyclopent-3-en-1-yl)hept-4-ynoic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC#CCCC1C(C=CC1=O)O

Isomeric SMILES

COC(=O)CCC#CCCC1C(C=CC1=O)O

InChI

InChI=1S/C13H16O4/c1-17-13(16)7-5-3-2-4-6-10-11(14)8-9-12(10)15/h8-11,14H,4-7H2,1H3