6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-8-carboxylic acid

Systemtic Name: 6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-8-carboxylic acid Openeye Name: 6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-8-carboxylic acid CAS Name: 6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-8-carboxylic acid IUPAC Name: 6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-8-carboxylic acid Traditional Name: 6-methyl-2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-8-carboxylic acid Formula: C12H8Cl6O4 MolecularWeight: 428.90752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C(=O)O)OC(OC2C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

Isomeric SMILES

CC1=CC2=C(C(=C1)C(=O)O)OC(OC2C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

InChI

InChI=1S/C12H8Cl6O4/c1-4-2-5-7(6(3-4)9(19)20)21-10(12(16,17)18)22-8(5)11(13,14)15/h2-3,8,10H,1H3,(H,19,20)