N,N-bis(cyanomethyl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N,N-bis(cyanomethyl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N,N-bis(cyanomethyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N,N-bis(cyanomethyl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N,N-bis(cyanomethyl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N,N-bis(cyanomethyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C10H8N4O5S MolecularWeight: 296.25932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N(CC#N)CC#N)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N(CC#N)CC#N)[N+](=O)[O-])O

InChI

InChI=1S/C10H8N4O5S/c11-3-5-13(6-4-12)20(18,19)8-1-2-10(15)9(7-8)14(16)17/h1-2,7,15H,5-6H2