4-(3-azanylpropylamino)-N,N-dimethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(3-azanylpropylamino)-N,N-dimethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(3-aminopropylamino)-N,N-dimethyl-3-nitro-benzenesulfonamide CAS Name: 4-(3-aminopropylamino)-N,N-dimethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-aminopropylamino)-N,N-dimethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(3-aminopropylamino)-N,N-dimethyl-3-nitro-benzenesulfonamide Formula: C11H18N4O4S MolecularWeight: 302.35002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18N4O4S/c1-14(2)20(18,19)9-4-5-10(13-7-3-6-12)11(8-9)15(16)17/h4-5,8,13H,3,6-7,12H2,1-2H3