2-(2-methylphenyl)carbonyl-2,3-bis(oxidanyl)butanedioic acid

Systemtic Name: 2-(2-methylphenyl)carbonyl-2,3-bis(oxidanyl)butanedioic acid Openeye Name: 2,3-dihydroxy-2-(2-methylbenzoyl)butanedioic acid CAS Name: 2,3-dihydroxy-2-[(2-methylphenyl)-oxomethyl]butanedioic acid IUPAC Name: 2,3-dihydroxy-2-(2-methylbenzoyl)butanedioic acid Traditional Name: 2,3-dihydroxy-2-o-toluoyl-succinic acid Formula: C12H12O7 MolecularWeight: 268.21948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C12H12O7/c1-6-4-2-3-5-7(6)8(13)12(19,11(17)18)9(14)10(15)16/h2-5,9,14,19H,1H3,(H,15,16)(H,17,18)