1-(hydroxymethyl)-2-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 1-(hydroxymethyl)-2-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 2-hydroxy-1-(hydroxymethyl)cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 2-hydroxy-1-(hydroxymethyl)-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 2-hydroxy-1-(hydroxymethyl)cyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 2-hydroxy-1-methylol-cyclohexa-2,4-diene-1-carboxylic acid Formula: C8H10O4 MolecularWeight: 170.1626

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C(C1(CO)C(=O)O)O

Isomeric SMILES

C1C=CC=C(C1(CO)C(=O)O)O

InChI

InChI=1S/C8H10O4/c9-5-8(7(11)12)4-2-1-3-6(8)10/h1-3,9-10H,4-5H2,(H,11,12)