4-(2-chloranyl-4-cyano-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-chloranyl-4-cyano-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2-chloro-4-cyano-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(2-chloro-4-cyanophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-chloro-4-cyanophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(2-chloro-4-cyano-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C#N)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-3-20(4-2)27(24,25)13-6-8-17(15(10-13)21(22)23)26-16-7-5-12(11-19)9-14(16)18/h5-10H,3-4H2,1-2H3