N-[3-(4-azanylbutylamino)propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-azanylbutylamino)propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(4-aminobutylamino)propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(4-aminobutylamino)propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-aminobutylamino)propyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(4-aminobutylamino)propyl]-4-nitro-benzenesulfonamide Formula: C13H22N4O4S MolecularWeight: 330.40318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NCCCNCCCCN

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NCCCNCCCCN

InChI

InChI=1S/C13H22N4O4S/c14-8-1-2-9-15-10-3-11-16-22(20,21)13-6-4-12(5-7-13)17(18)19/h4-7,15-16H,1-3,8-11,14H2