N,N-dimethyl-3-nitro-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-nitro-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N,N-dimethyl-3-nitro-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N,N-dimethyl-3-nitro-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N,N-dimethyl-3-nitro-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N,N-dimethyl-3-nitro-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C12H17N3O6S2 MolecularWeight: 363.40988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O6S2/c1-13(2)22(18,19)10-5-6-12(11(9-10)15(16)17)23(20,21)14-7-3-4-8-14/h5-6,9H,3-4,7-8H2,1-2H3