4-methyl-5-oxidanyl-cyclopent-4-ene-1,3-dione hydrate

Systemtic Name: 4-methyl-5-oxidanyl-cyclopent-4-ene-1,3-dione hydrate Openeye Name: 4-hydroxy-5-methyl-cyclopent-4-ene-1,3-dione hydrate CAS Name: 4-hydroxy-5-methylcyclopent-4-ene-1,3-dione hydrate IUPAC Name: 4-hydroxy-5-methylcyclopent-4-ene-1,3-dione hydrate Traditional Name: 4-hydroxy-5-methyl-cyclopent-4-ene-1,3-quinone hydrate Formula: C6H8O4 MolecularWeight: 144.12532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC1=O)O.O

Isomeric SMILES

CC1=C(C(=O)CC1=O)O.O

InChI

InChI=1S/C6H6O3.H2O/c1-3-4(7)2-5(8)6(3)9;/h9H,2H2,1H3;1H2