dimethyl 3,8-bis(chloranyl)thianthrene-2,7-disulfonate

Systemtic Name: dimethyl 3,8-bis(chloranyl)thianthrene-2,7-disulfonate Openeye Name: dimethyl 3,8-dichlorothianthrene-2,7-disulfonate CAS Name: 3,8-dichlorothianthrene-2,7-disulfonic acid dimethyl ester IUPAC Name: dimethyl 3,8-dichlorothianthrene-2,7-disulfonate Traditional Name: 3,8-dichlorothianthrene-2,7-disulfonic acid dimethyl ester Formula: C14H10Cl2O6S4 MolecularWeight: 473.3916

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=C(C=C2C(=C1)SC3=CC(=C(C=C3S2)S(=O)(=O)OC)Cl)Cl

Isomeric SMILES

COS(=O)(=O)C1=C(C=C2C(=C1)SC3=CC(=C(C=C3S2)S(=O)(=O)OC)Cl)Cl

InChI

InChI=1S/C14H10Cl2O6S4/c1-21-25(17,18)13-5-11-9(3-7(13)15)24-12-6-14(26(19,20)22-2)8(16)4-10(12)23-11/h3-6H,1-2H3