2,4-bis(chloranyl)-5-[2,4,5-tris(chloranyl)phenyl]benzoate; methanol

Systemtic Name: 2,4-bis(chloranyl)-5-[2,4,5-tris(chloranyl)phenyl]benzoate; methanol Openeye Name: 2,4-dichloro-5-(2,4,5-trichlorophenyl)benzoate; methanol CAS Name: 2,4-dichloro-5-(2,4,5-trichlorophenyl)benzoate; methanol IUPAC Name: 2,4-dichloro-5-(2,4,5-trichlorophenyl)benzoate; methanol Traditional Name: 2,4-dichloro-5-(2,4,5-trichlorophenyl)benzoate; methanol Formula: C14H8Cl5O3- MolecularWeight: 401.47652

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Descriptors Computed from Structure

Canonical SMILES:

CO.C1=C(C(=CC(=C1C(=O)[O-])Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CO.C1=C(C(=CC(=C1C(=O)[O-])Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H5Cl5O2.CH4O/c14-8-3-10(16)7(13(19)20)1-5(8)6-2-11(17)12(18)4-9(6)15;1-2/h1-4H,(H,19,20);2H,1H3/p-1