methyl 4,4-dimethyl-2-oxidanylidene-1-prop-2-ynyl-cyclopentane-1-carboxylate

Systemtic Name: methyl 4,4-dimethyl-2-oxidanylidene-1-prop-2-ynyl-cyclopentane-1-carboxylate Openeye Name: methyl 4,4-dimethyl-2-oxo-1-prop-2-ynyl-cyclopentanecarboxylate CAS Name: 4,4-dimethyl-2-oxo-1-prop-2-ynyl-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 4,4-dimethyl-2-oxo-1-prop-2-ynylcyclopentane-1-carboxylate Traditional Name: 2-keto-4,4-dimethyl-1-propargyl-cyclopentanecarboxylic acid methyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C1)(CC#C)C(=O)OC)C

Isomeric SMILES

CC1(CC(=O)C(C1)(CC#C)C(=O)OC)C

InChI

InChI=1S/C12H16O3/c1-5-6-12(10(14)15-4)8-11(2,3)7-9(12)13/h1H,6-8H2,2-4H3