2,2-dimethyl-3-[3-(2-methylpropoxy)-3-oxidanylidene-prop-1-ynyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2,2-dimethyl-3-[3-(2-methylpropoxy)-3-oxidanylidene-prop-1-ynyl]cyclopropane-1-carboxylic acid Openeye Name: 3-(3-isobutoxy-3-oxo-prop-1-ynyl)-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 2,2-dimethyl-3-[3-(2-methylpropoxy)-3-oxoprop-1-ynyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2,2-dimethyl-3-[3-(2-methylpropoxy)-3-oxoprop-1-ynyl]cyclopropane-1-carboxylic acid Traditional Name: 3-(3-isobutoxy-3-keto-prop-1-ynyl)-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C#CC1C(C1(C)C)C(=O)O

Isomeric SMILES

CC(C)COC(=O)C#CC1C(C1(C)C)C(=O)O

InChI

InChI=1S/C13H18O4/c1-8(2)7-17-10(14)6-5-9-11(12(15)16)13(9,3)4/h8-9,11H,7H2,1-4H3,(H,15,16)