2-[[2-chloranyl-3-nitro-1-(trichloromethyl)cyclohexa-2,4-dien-1-yl]disulfanyl]benzenecarbonitrile

Systemtic Name: 2-[[2-chloranyl-3-nitro-1-(trichloromethyl)cyclohexa-2,4-dien-1-yl]disulfanyl]benzenecarbonitrile Openeye Name: 2-[[2-chloro-3-nitro-1-(trichloromethyl)cyclohexa-2,4-dien-1-yl]disulfanyl]benzonitrile CAS Name: 2-[[2-chloro-3-nitro-1-(trichloromethyl)-1-cyclohexa-2,4-dienyl]disulfanyl]benzonitrile IUPAC Name: 2-[[2-chloro-3-nitro-1-(trichloromethyl)cyclohexa-2,4-dien-1-yl]disulfanyl]benzonitrile Traditional Name: 2-[[2-chloro-3-nitro-1-(trichloromethyl)cyclohexa-2,4-dien-1-yl]disulfanyl]benzonitrile Formula: C14H8Cl4N2O2S2 MolecularWeight: 442.16752

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=C(C1(C(Cl)(Cl)Cl)SSC2=CC=CC=C2C#N)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C=CC(=C(C1(C(Cl)(Cl)Cl)SSC2=CC=CC=C2C#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H8Cl4N2O2S2/c15-12-10(20(21)22)5-3-7-13(12,14(16,17)18)24-23-11-6-2-1-4-9(11)8-19/h1-6H,7H2