3-ethynylphthalic acid

Systemtic Name: 3-ethynylphthalic acid Openeye Name: 3-ethynylphthalic acid CAS Name: 3-ethynylphthalic acid IUPAC Name: 3-ethynylphthalic acid Traditional Name: 3-ethynylphthalic acid Formula: C10H6O4 MolecularWeight: 190.15224

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C(=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

C#CC1=C(C(=CC=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C10H6O4/c1-2-6-4-3-5-7(9(11)12)8(6)10(13)14/h1,3-5H,(H,11,12)(H,13,14)