O-(6-tert-butyl-3-methyl-2,4-dinitro-phenyl) N,N-dimethylcarbamothioate

Systemtic Name: O-(6-tert-butyl-3-methyl-2,4-dinitro-phenyl) N,N-dimethylcarbamothioate Openeye Name: O-(6-tert-butyl-3-methyl-2,4-dinitro-phenyl) N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid O-(6-tert-butyl-3-methyl-2,4-dinitrophenyl) ester IUPAC Name: O-(6-tert-butyl-3-methyl-2,4-dinitrophenyl) N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid O-(6-tert-butyl-3-methyl-2,4-dinitro-phenyl) ester Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1[N+](=O)[O-])OC(=S)N(C)C)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C(=C1[N+](=O)[O-])OC(=S)N(C)C)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-8-10(16(18)19)7-9(14(2,3)4)12(11(8)17(20)21)22-13(23)15(5)6/h7H,1-6H3