but-3-ynyl 3,5-dimethyl-7-oxidanylidene-6-oxabicyclo[3.2.1]octane-2-carboxylate

Systemtic Name: but-3-ynyl 3,5-dimethyl-7-oxidanylidene-6-oxabicyclo[3.2.1]octane-2-carboxylate Openeye Name: but-3-ynyl 3,5-dimethyl-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylate CAS Name: 3,5-dimethyl-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylic acid but-3-ynyl ester IUPAC Name: but-3-ynyl 3,5-dimethyl-7-oxo-6-oxabicyclo[3.2.1]octane-2-carboxylate Traditional Name: 7-keto-3,5-dimethyl-6-oxabicyclo[3.2.1]octane-2-carboxylic acid but-3-ynyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2(CC(C1C(=O)OCCC#C)C(=O)O2)C

Isomeric SMILES

CC1CC2(CC(C1C(=O)OCCC#C)C(=O)O2)C

InChI

InChI=1S/C14H18O4/c1-4-5-6-17-13(16)11-9(2)7-14(3)8-10(11)12(15)18-14/h1,9-11H,5-8H2,2-3H3