1,5-bis(chloranyl)-3-(2,4-dichlorophenyl)sulfanyl-2,4-dinitro-6-(trifluoromethyl)benzene

Systemtic Name: 1,5-bis(chloranyl)-3-(2,4-dichlorophenyl)sulfanyl-2,4-dinitro-6-(trifluoromethyl)benzene Openeye Name: 1,5-dichloro-3-(2,4-dichlorophenyl)sulfanyl-2,4-dinitro-6-(trifluoromethyl)benzene CAS Name: 1,5-dichloro-3-[(2,4-dichlorophenyl)thio]-2,4-dinitro-6-(trifluoromethyl)benzene IUPAC Name: 1,5-dichloro-3-(2,4-dichlorophenyl)sulfanyl-2,4-dinitro-6-(trifluoromethyl)benzene Traditional Name: 1,5-dichloro-3-[(2,4-dichlorophenyl)thio]-2,4-dinitro-6-(trifluoromethyl)benzene Formula: C13H3Cl4F3N2O4S MolecularWeight: 482.04613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)SC2=C(C(=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)SC2=C(C(=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H3Cl4F3N2O4S/c14-4-1-2-6(5(15)3-4)27-12-10(21(23)24)8(16)7(13(18,19)20)9(17)11(12)22(25)26/h1-3H