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

Systemtic Name: 2-chloranyl-1,6-dimethyl-4,9-dinitro-thianthrene Openeye Name: 2-chloro-1,6-dimethyl-4,9-dinitro-thianthrene CAS Name: 2-chloro-1,6-dimethyl-4,9-dinitrothianthrene IUPAC Name: 2-chloro-1,6-dimethyl-4,9-dinitrothianthrene Traditional Name: 2-chloro-1,6-dimethyl-4,9-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(=CC(=C3C)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C=C1)[N+](=O)[O-])SC3=C(S2)C(=CC(=C3C)Cl)[N+](=O)[O-]

InChI

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