2-[3-(dimethylamino)propylamino]-N-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 2-[3-(dimethylamino)propylamino]-N-methyl-5-nitro-benzenesulfonamide Openeye Name: 2-[3-(dimethylamino)propylamino]-N-methyl-5-nitro-benzenesulfonamide CAS Name: 2-[3-(dimethylamino)propylamino]-N-methyl-5-nitrobenzenesulfonamide IUPAC Name: 2-[3-(dimethylamino)propylamino]-N-methyl-5-nitrobenzenesulfonamide Traditional Name: 2-[3-(dimethylamino)propylamino]-N-methyl-5-nitro-benzenesulfonamide Formula: C12H20N4O4S MolecularWeight: 316.3766

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCCCN(C)C

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCCCN(C)C

InChI

InChI=1S/C12H20N4O4S/c1-13-21(19,20)12-9-10(16(17)18)5-6-11(12)14-7-4-8-15(2)3/h5-6,9,13-14H,4,7-8H2,1-3H3