bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-4,5-dimethoxy-2-oxidanyl-benzoic acid

Systemtic Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-4,5-dimethoxy-2-oxidanyl-benzoic acid Openeye Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-2-hydroxy-4,5-dimethoxy-benzoic acid CAS Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-2-hydroxy-4,5-dimethoxybenzoic acid IUPAC Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-2-hydroxy-4,5-dimethoxybenzoic acid Traditional Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; 3-ethynyl-2-hydroxy-4,5-dimethoxy-benzoic acid Formula: C17H14O5 MolecularWeight: 298.29006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)O)O)C#C)OC.C1=CC2=CC2=C1

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)O)O)C#C)OC.C1=CC2=CC2=C1

InChI

InChI=1S/C11H10O5.C6H4/c1-4-6-9(12)7(11(13)14)5-8(15-2)10(6)16-3;1-2-5-4-6(5)3-1/h1,5,12H,2-3H3,(H,13,14);1-4H