3,6-bis(chloranyl)-4,5-bis(ethylsulfanyl)phthalic acid

Systemtic Name: 3,6-bis(chloranyl)-4,5-bis(ethylsulfanyl)phthalic acid Openeye Name: 3,6-dichloro-4,5-bis(ethylsulfanyl)phthalic acid CAS Name: 3,6-dichloro-4,5-bis(ethylthio)phthalic acid IUPAC Name: 3,6-dichloro-4,5-bis(ethylsulfanyl)phthalic acid Traditional Name: 3,6-dichloro-4,5-bis(ethylthio)phthalic acid Formula: C12H12Cl2O4S2 MolecularWeight: 355.25728

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=C(C(=C1SCC)Cl)C(=O)O)C(=O)O)Cl

Isomeric SMILES

CCSC1=C(C(=C(C(=C1SCC)Cl)C(=O)O)C(=O)O)Cl

InChI

InChI=1S/C12H12Cl2O4S2/c1-3-19-9-7(13)5(11(15)16)6(12(17)18)8(14)10(9)20-4-2/h3-4H2,1-2H3,(H,15,16)(H,17,18)