4-methyl-N-(3-methylpyridin-2-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(3-methylpyridin-2-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-(3-methyl-2-pyridyl)-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-(3-methyl-2-pyridinyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(3-methylpyridin-2-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-(3-methyl-2-pyridyl)-3-nitro-benzenesulfonamide Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4S/c1-9-5-6-11(8-12(9)16(17)18)21(19,20)15-13-10(2)4-3-7-14-13/h3-8H,1-2H3,(H,14,15)