[7-nitro-2-oxidanylidene-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] N,N-dimethylsulfamate

Systemtic Name: [7-nitro-2-oxidanylidene-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] N,N-dimethylsulfamate Openeye Name: [7-nitro-2-oxo-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] N,N-dimethylsulfamate CAS Name: N,N-dimethylsulfamic acid [7-nitro-2-oxo-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] ester IUPAC Name: [7-nitro-2-oxo-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] N,N-dimethylsulfamate Traditional Name: N,N-dimethylsulfamic acid [2-keto-7-nitro-5-(trifluoromethyl)-1,3-benzothiazol-3-yl] ester Formula: C10H8F3N3O6S2 MolecularWeight: 387.31223

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)ON1C2=C(C(=CC(=C2)C(F)(F)F)[N+](=O)[O-])SC1=O

Isomeric SMILES

CN(C)S(=O)(=O)ON1C2=C(C(=CC(=C2)C(F)(F)F)[N+](=O)[O-])SC1=O

InChI

InChI=1S/C10H8F3N3O6S2/c1-14(2)24(20,21)22-15-6-3-5(10(11,12)13)4-7(16(18)19)8(6)23-9(15)17/h3-4H,1-2H3