4-[[(2,6-dimethyl-3-nitro-pyridin-4-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(2,6-dimethyl-3-nitro-pyridin-4-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridyl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridinyl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(2,6-dimethyl-3-nitropyridin-4-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridyl)amino]methyl]benzenesulfonamide Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=NC(=C(C(=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C

InChI

InChI=1S/C14H16N4O4S/c1-9-7-13(14(18(19)20)10(2)17-9)16-8-11-3-5-12(6-4-11)23(15,21)22/h3-7H,8H2,1-2H3,(H,16,17)(H2,15,21,22)