2-chloranyl-1,9-dimethyl-4,6-dinitro-thianthrene

Systemtic Name: 2-chloranyl-1,9-dimethyl-4,6-dinitro-thianthrene Openeye Name: 2-chloro-1,9-dimethyl-4,6-dinitro-thianthrene CAS Name: 2-chloro-1,9-dimethyl-4,6-dinitrothianthrene IUPAC Name: 2-chloro-1,9-dimethyl-4,6-dinitrothianthrene Traditional Name: 2-chloro-1,9-dimethyl-4,6-dinitro-thianthrene Formula: C14H9ClN2O4S2 MolecularWeight: 368.81526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)[N+](=O)[O-])SC3=C(S2)C(=C(C=C3[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C2C(=C(C=C1)[N+](=O)[O-])SC3=C(S2)C(=C(C=C3[N+](=O)[O-])Cl)C

InChI

InChI=1S/C14H9ClN2O4S2/c1-6-3-4-9(16(18)19)13-11(6)22-12-7(2)8(15)5-10(17(20)21)14(12)23-13/h3-5H,1-2H3