2-(2-methylbut-3-yn-2-yloxycarbonyl)benzoic acid

Systemtic Name: 2-(2-methylbut-3-yn-2-yloxycarbonyl)benzoic acid Openeye Name: 2-(1,1-dimethylprop-2-ynoxycarbonyl)benzoic acid CAS Name: 2-[2-methylbut-3-yn-2-yloxy(oxo)methyl]benzoic acid IUPAC Name: 2-(2-methylbut-3-yn-2-yloxycarbonyl)benzoic acid Traditional Name: 2-(1,1-dimethylprop-2-ynoxycarbonyl)benzoic acid Formula: C13H12O4 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)(C#C)OC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H12O4/c1-4-13(2,3)17-12(16)10-8-6-5-7-9(10)11(14)15/h1,5-8H,2-3H3,(H,14,15)