2-chloranyl-N-(2-cyanoethyl)-N-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(2-cyanoethyl)-N-methyl-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-(2-cyanoethyl)-N-methyl-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-(2-cyanoethyl)-N-methyl-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-(2-cyanoethyl)-N-methyl-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-(2-cyanoethyl)-N-methyl-5-nitro-benzenesulfonamide Formula: C10H10ClN3O4S MolecularWeight: 303.7221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN3O4S/c1-13(6-2-5-12)19(17,18)10-7-8(14(15)16)3-4-9(10)11/h3-4,7H,2,6H2,1H3