[1-(2-chloranyl-5-nitro-phenyl)-2-nitro-ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [1-(2-chloranyl-5-nitro-phenyl)-2-nitro-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [1-(2-chloro-5-nitro-phenyl)-2-nitro-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [1-(2-chloro-5-nitrophenyl)-2-nitroethyl] ester IUPAC Name: [1-(2-chloro-5-nitrophenyl)-2-nitroethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [1-(2-chloro-5-nitro-phenyl)-2-nitro-ethyl] ester Formula: C11H12ClN3O4S2 MolecularWeight: 349.81368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SC(C[N+](=O)[O-])C1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)C(=S)SC(C[N+](=O)[O-])C1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12ClN3O4S2/c1-13(2)11(20)21-10(6-14(16)17)8-5-7(15(18)19)3-4-9(8)12/h3-5,10H,6H2,1-2H3