4-[[(3-nitropyridin-2-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(3-nitropyridin-2-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(3-nitro-2-pyridyl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(3-nitro-2-pyridinyl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(3-nitropyridin-2-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(3-nitro-2-pyridyl)amino]methyl]benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c13-21(19,20)10-5-3-9(4-6-10)8-15-12-11(16(17)18)2-1-7-14-12/h1-7H,8H2,(H,14,15)(H2,13,19,20)