1-tert-butyl-2,2-dimethyl-3-(3-oxidanylidene-3-pentoxy-prop-1-ynyl)cyclopropane-1-carboxylic acid

Systemtic Name: 1-tert-butyl-2,2-dimethyl-3-(3-oxidanylidene-3-pentoxy-prop-1-ynyl)cyclopropane-1-carboxylic acid Openeye Name: 1-tert-butyl-2,2-dimethyl-3-(3-oxo-3-pentoxy-prop-1-ynyl)cyclopropanecarboxylic acid CAS Name: 1-tert-butyl-2,2-dimethyl-3-(3-oxo-3-pentoxyprop-1-ynyl)-1-cyclopropanecarboxylic acid IUPAC Name: 1-tert-butyl-2,2-dimethyl-3-(3-oxo-3-pentoxyprop-1-ynyl)cyclopropane-1-carboxylic acid Traditional Name: 3-(3-amoxy-3-keto-prop-1-ynyl)-1-tert-butyl-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C#CC1C(C1(C(=O)O)C(C)(C)C)(C)C

Isomeric SMILES

CCCCCOC(=O)C#CC1C(C1(C(=O)O)C(C)(C)C)(C)C

InChI

InChI=1S/C18H28O4/c1-7-8-9-12-22-14(19)11-10-13-17(5,6)18(13,15(20)21)16(2,3)4/h13H,7-9,12H2,1-6H3,(H,20,21)