4-chloranyl-N-(2-cyanoethyl)-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-cyanoethyl)-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2-cyanoethyl)-N-methyl-3-nitro-benzenesulfonamide Formula: C10H10ClN3O4S MolecularWeight: 303.7221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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