2-nitro-N-[6-[(3-nitropyridin-2-yl)amino]hexyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[6-[(3-nitropyridin-2-yl)amino]hexyl]benzenesulfonamide Openeye Name: 2-nitro-N-[6-[(3-nitro-2-pyridyl)amino]hexyl]benzenesulfonamide CAS Name: 2-nitro-N-[6-[(3-nitro-2-pyridinyl)amino]hexyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[6-[(3-nitropyridin-2-yl)amino]hexyl]benzenesulfonamide Traditional Name: 2-nitro-N-[6-[(3-nitro-2-pyridyl)amino]hexyl]benzenesulfonamide Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCCCCNC2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCCCCNC2=C(C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O6S/c23-21(24)14-8-3-4-10-16(14)29(27,28)20-13-6-2-1-5-11-18-17-15(22(25)26)9-7-12-19-17/h3-4,7-10,12,20H,1-2,5-6,11,13H2,(H,18,19)