2-methylbut-3-yn-2-yl benzoate

Systemtic Name: 2-methylbut-3-yn-2-yl benzoate Openeye Name: 1,1-dimethylprop-2-ynyl benzoate CAS Name: benzoic acid 2-methylbut-3-yn-2-yl ester IUPAC Name: 2-methylbut-3-yn-2-yl benzoate Traditional Name: benzoic acid 1,1-dimethylprop-2-ynyl ester Formula: C12H12O2 MolecularWeight: 188.22248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O2/c1-4-12(2,3)14-11(13)10-8-6-5-7-9-10/h1,5-9H,2-3H3