[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O3S2/c16-12(9-20-13(19)14-7-1-2-8-14)10-3-5-11(6-4-10)15(17)18/h3-6H,1-2,7-9H2