4-methyl-3,5-bis(oxidanyl)benzoic acid hydrate

Systemtic Name: 4-methyl-3,5-bis(oxidanyl)benzoic acid hydrate Openeye Name: 3,5-dihydroxy-4-methyl-benzoic acid hydrate CAS Name: 3,5-dihydroxy-4-methylbenzoic acid hydrate IUPAC Name: 3,5-dihydroxy-4-methylbenzoic acid hydrate Traditional Name: 3,5-dihydroxy-4-methyl-benzoic acid hydrate Formula: C8H10O5 MolecularWeight: 186.162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1O)C(=O)O)O.O

Isomeric SMILES

CC1=C(C=C(C=C1O)C(=O)O)O.O

InChI

InChI=1S/C8H8O4.H2O/c1-4-6(9)2-5(8(11)12)3-7(4)10;/h2-3,9-10H,1H3,(H,11,12);1H2