1-[2,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethanone hydrate

Systemtic Name: 1-[2,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethanone hydrate Openeye Name: 1-(2,4-dihydroxyphenyl)-2-hydroxy-ethanone hydrate CAS Name: 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone hydrate IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone hydrate Traditional Name: 1-(2,4-dihydroxyphenyl)-2-hydroxy-ethanone hydrate Formula: C8H10O5 MolecularWeight: 186.162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)O)C(=O)CO.O

Isomeric SMILES

C1=CC(=C(C=C1O)O)C(=O)CO.O

InChI

InChI=1S/C8H8O4.H2O/c9-4-8(12)6-2-1-5(10)3-7(6)11;/h1-3,9-11H,4H2;1H2