2,3-dimethyl-N-[3-(methylsulfonylamino)propyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-[3-(methylsulfonylamino)propyl]-5-nitro-benzenesulfonamide Openeye Name: N-[3-(methanesulfonamido)propyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[3-(methanesulfonamido)propyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-(methanesulfonamido)propyl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-(methanesulfonamido)propyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C12H19N3O6S2 MolecularWeight: 365.42576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NCCCNS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NCCCNS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O6S2/c1-9-7-11(15(16)17)8-12(10(9)2)23(20,21)14-6-4-5-13-22(3,18)19/h7-8,13-14H,4-6H2,1-3H3