4-[2-cyanoethyl(methyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-cyanoethyl(methyl)amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[2-cyanoethyl(methyl)amino]-3-nitro-benzenesulfonamide CAS Name: 4-[2-cyanoethyl(methyl)amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-cyanoethyl(methyl)amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[2-cyanoethyl(methyl)amino]-3-nitro-benzenesulfonamide Formula: C10H12N4O4S MolecularWeight: 284.29168

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)C1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O4S/c1-13(6-2-5-11)9-4-3-8(19(12,17)18)7-10(9)14(15)16/h3-4,7H,2,6H2,1H3,(H2,12,17,18)