butan-1-ol; 3,4,5,6-tetrakis(chloranyl)phthalic acid

Systemtic Name: butan-1-ol; 3,4,5,6-tetrakis(chloranyl)phthalic acid Openeye Name: butan-1-ol; 3,4,5,6-tetrachlorophthalic acid CAS Name: 1-butanol; 3,4,5,6-tetrachlorophthalic acid IUPAC Name: butan-1-ol; 3,4,5,6-tetrachlorophthalic acid Traditional Name: butan-1-ol; 3,4,5,6-tetrachlorophthalic acid Formula: C12H12Cl4O5 MolecularWeight: 378.03268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O)C(=O)O

Isomeric SMILES

CCCCO.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C8H2Cl4O4.C4H10O/c9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11;1-2-3-4-5/h(H,13,14)(H,15,16);5H,2-4H2,1H3