bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid

Systemtic Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid Openeye Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid CAS Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid IUPAC Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid Traditional Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynylphthalic acid Formula: C16H10O4 MolecularWeight: 266.2482

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C(=CC=C1)C(=O)O)C(=O)O.C1=CC2=CC2=C1

Isomeric SMILES

C#CC1=C(C(=CC=C1)C(=O)O)C(=O)O.C1=CC2=CC2=C1

InChI

InChI=1S/C10H6O4.C6H4/c1-2-6-4-3-5-7(9(11)12)8(6)10(13)14;1-2-5-4-6(5)3-1/h1,3-5H,(H,11,12)(H,13,14);1-4H