5,5-dimethyl-2-oxidanyl-hex-3-ynoate

Systemtic Name: 5,5-dimethyl-2-oxidanyl-hex-3-ynoate Openeye Name: 2-hydroxy-5,5-dimethyl-hex-3-ynoate CAS Name: 2-hydroxy-5,5-dimethyl-3-hexynoate IUPAC Name: 2-hydroxy-5,5-dimethylhex-3-ynoate Traditional Name: 2-hydroxy-5,5-dimethyl-hex-3-ynoate Formula: C8H11O3- MolecularWeight: 155.17114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC(C(=O)[O-])O

Isomeric SMILES

CC(C)(C)C#CC(C(=O)[O-])O

InChI

InChI=1S/C8H12O3/c1-8(2,3)5-4-6(9)7(10)11/h6,9H,1-3H3,(H,10,11)/p-1