O-(4-iodanyl-3-nitro-phenyl) N,N-diethylcarbamothioate

Systemtic Name: O-(4-iodanyl-3-nitro-phenyl) N,N-diethylcarbamothioate Openeye Name: O-(4-iodo-3-nitro-phenyl) N,N-diethylcarbamothioate CAS Name: N,N-diethylcarbamothioic acid O-(4-iodo-3-nitrophenyl) ester IUPAC Name: O-(4-iodo-3-nitrophenyl) N,N-diethylcarbamothioate Traditional Name: N,N-diethylthiocarbamic acid O-(4-iodo-3-nitro-phenyl) ester Formula: C11H13IN2O3S MolecularWeight: 380.20199

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)OC1=CC(=C(C=C1)I)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=S)OC1=CC(=C(C=C1)I)[N+](=O)[O-]

InChI

InChI=1S/C11H13IN2O3S/c1-3-13(4-2)11(18)17-8-5-6-9(12)10(7-8)14(15)16/h5-7H,3-4H2,1-2H3