(4-ethanoyl-2-nitro-phenyl) pyrrolidine-1-carbodithioate

Systemtic Name: (4-ethanoyl-2-nitro-phenyl) pyrrolidine-1-carbodithioate Openeye Name: (4-acetyl-2-nitro-phenyl) pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid (4-acetyl-2-nitrophenyl) ester IUPAC Name: (4-acetyl-2-nitrophenyl) pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (4-acetyl-2-nitro-phenyl) ester Formula: C13H14N2O3S2 MolecularWeight: 310.39186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SC(=S)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SC(=S)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O3S2/c1-9(16)10-4-5-12(11(8-10)15(17)18)20-13(19)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3