N-(2-cyanoethyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-3-nitro-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-3-nitro-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-3-nitrobenzenesulfonamide Traditional Name: N-(2-cyanoethyl)-3-nitro-benzenesulfonamide Formula: C9H9N3O4S MolecularWeight: 255.25046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N3O4S/c10-5-2-6-11-17(15,16)9-4-1-3-8(7-9)12(13)14/h1,3-4,7,11H,2,6H2