4,5,6-tris(chloranyl)-1-methyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid

Systemtic Name: 4,5,6-tris(chloranyl)-1-methyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid Openeye Name: 4,5,6-trichloro-1-methyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid CAS Name: 4,5,6-trichloro-1-methylcyclohexa-3,5-diene-1,2-dicarboxylic acid IUPAC Name: 4,5,6-trichloro-1-methylcyclohexa-3,5-diene-1,2-dicarboxylic acid Traditional Name: 4,5,6-trichloro-1-methyl-cyclohexa-3,5-diene-1,2-dicarboxylic acid Formula: C9H7Cl3O4 MolecularWeight: 285.50848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C=C(C(=C1Cl)Cl)Cl)C(=O)O)C(=O)O

Isomeric SMILES

CC1(C(C=C(C(=C1Cl)Cl)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C9H7Cl3O4/c1-9(8(15)16)3(7(13)14)2-4(10)5(11)6(9)12/h2-3H,1H3,(H,13,14)(H,15,16)