2,3,7,8-tetrakis(chloranyl)-1,6-dimethyl-4,9-dinitro-thianthrene

Systemtic Name: 2,3,7,8-tetrakis(chloranyl)-1,6-dimethyl-4,9-dinitro-thianthrene Openeye Name: 2,3,7,8-tetrachloro-1,6-dimethyl-4,9-dinitro-thianthrene CAS Name: 2,3,7,8-tetrachloro-1,6-dimethyl-4,9-dinitrothianthrene IUPAC Name: 2,3,7,8-tetrachloro-1,6-dimethyl-4,9-dinitrothianthrene Traditional Name: 2,3,7,8-tetrachloro-1,6-dimethyl-4,9-dinitro-thianthrene Formula: C14H6Cl4N2O4S2 MolecularWeight: 472.15044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1Cl)Cl)[N+](=O)[O-])SC3=C(C(=C(C(=C3S2)[N+](=O)[O-])Cl)Cl)C

Isomeric SMILES

CC1=C2C(=C(C(=C1Cl)Cl)[N+](=O)[O-])SC3=C(C(=C(C(=C3S2)[N+](=O)[O-])Cl)Cl)C

InChI

InChI=1S/C14H6Cl4N2O4S2/c1-3-5(15)7(17)9(19(21)22)13-11(3)25-14-10(20(23)24)8(18)6(16)4(2)12(14)26-13/h1-2H3