N-(cyanomethyl)-4-methyl-N-nitro-benzenesulfonamide

Systemtic Name: N-(cyanomethyl)-4-methyl-N-nitro-benzenesulfonamide Openeye Name: N-(cyanomethyl)-4-methyl-N-nitro-benzenesulfonamide CAS Name: N-(cyanomethyl)-4-methyl-N-nitrobenzenesulfonamide IUPAC Name: N-(cyanomethyl)-4-methyl-N-nitrobenzenesulfonamide Traditional Name: N-(cyanomethyl)-4-methyl-N-nitro-benzenesulfonamide Formula: C9H9N3O4S MolecularWeight: 255.25046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC#N)[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O4S/c1-8-2-4-9(5-3-8)17(15,16)11(7-6-10)12(13)14/h2-5H,7H2,1H3