O-(2,4-dinitrophenyl) carbamothioate

Systemtic Name: O-(2,4-dinitrophenyl) carbamothioate Openeye Name: O-(2,4-dinitrophenyl) carbamothioate CAS Name: carbamothioic acid O-(2,4-dinitrophenyl) ester IUPAC Name: O-(2,4-dinitrophenyl) carbamothioate Traditional Name: thiocarbamic acid O-(2,4-dinitrophenyl) ester Formula: C7H5N3O5S MolecularWeight: 243.1967

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5N3O5S/c8-7(16)15-6-2-1-4(9(11)12)3-5(6)10(13)14/h1-3H,(H2,8,16)