N,N-bis(2-cyanoethyl)-4-nitro-benzenesulfonamide

Systemtic Name: N,N-bis(2-cyanoethyl)-4-nitro-benzenesulfonamide Openeye Name: N,N-bis(2-cyanoethyl)-4-nitro-benzenesulfonamide CAS Name: N,N-bis(2-cyanoethyl)-4-nitrobenzenesulfonamide IUPAC Name: N,N-bis(2-cyanoethyl)-4-nitrobenzenesulfonamide Traditional Name: N,N-bis(2-cyanoethyl)-4-nitro-benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O4S/c13-7-1-9-15(10-2-8-14)21(19,20)12-5-3-11(4-6-12)16(17)18/h3-6H,1-2,9-10H2