methyl 7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)hept-5-ynoate

Systemtic Name: methyl 7-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)hept-5-ynoate Openeye Name: methyl 7-(3-hydroxy-5-oxo-cyclopenten-1-yl)hept-5-ynoate CAS Name: 7-(3-hydroxy-5-oxo-1-cyclopentenyl)-5-heptynoic acid methyl ester IUPAC Name: methyl 7-(3-hydroxy-5-oxocyclopenten-1-yl)hept-5-ynoate Traditional Name: 7-(3-hydroxy-5-keto-cyclopenten-1-yl)hept-5-ynoic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC#CCC1=CC(CC1=O)O

Isomeric SMILES

COC(=O)CCCC#CCC1=CC(CC1=O)O

InChI

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