N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-4-nitro-benzenesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O4S/c1-13(2,10-15(3)4)9-14-21(19,20)12-7-5-11(6-8-12)16(17)18/h5-8,14H,9-10H2,1-4H3