[2,6-dinitro-4-(trifluoromethyl)phenyl] N,N-diethylcarbamodithioate

Systemtic Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] N,N-diethylcarbamodithioate Openeye Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2,6-dinitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2,6-dinitro-4-(trifluoromethyl)phenyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2,6-dinitro-4-(trifluoromethyl)phenyl] ester Formula: C12H12F3N3O4S2 MolecularWeight: 383.36659

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=S)SC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H12F3N3O4S2/c1-3-16(4-2)11(23)24-10-8(17(19)20)5-7(12(13,14)15)6-9(10)18(21)22/h5-6H,3-4H2,1-2H3