1,3-bis(chloranyl)-2-isothiocyanato-5-nitro-benzene

Systemtic Name: 1,3-bis(chloranyl)-2-isothiocyanato-5-nitro-benzene Openeye Name: 1,3-dichloro-2-isothiocyanato-5-nitro-benzene CAS Name: 1,3-dichloro-2-isothiocyanato-5-nitrobenzene IUPAC Name: 1,3-dichloro-2-isothiocyanato-5-nitrobenzene Traditional Name: 1,3-dichloro-2-isothiocyanato-5-nitro-benzene Formula: C7H2Cl2N2O2S MolecularWeight: 249.07398

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N=C=S)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N=C=S)Cl)[N+](=O)[O-]

InChI

InChI=1S/C7H2Cl2N2O2S/c8-5-1-4(11(12)13)2-6(9)7(5)10-3-14/h1-2H