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

Systemtic Name: (4-methylsulfonyl-2-nitro-phenyl) pyrrolidine-1-carbodithioate Openeye Name: (4-methylsulfonyl-2-nitro-phenyl) pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid (4-methylsulfonyl-2-nitrophenyl) ester IUPAC Name: (4-methylsulfonyl-2-nitrophenyl) pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (4-mesyl-2-nitro-phenyl) ester Formula: C12H14N2O4S3 MolecularWeight: 346.44556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4S3/c1-21(17,18)9-4-5-11(10(8-9)14(15)16)20-12(19)13-6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3