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

Systemtic Name: 4-(4-chloranyl-2-nitro-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(4-chloro-2-nitro-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(4-chloro-2-nitrophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(4-chloro-2-nitrophenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C16H16ClN3O7S MolecularWeight: 429.83214

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)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClN3O7S/c1-3-18(4-2)28(25,26)12-6-8-16(14(10-12)20(23)24)27-15-7-5-11(17)9-13(15)19(21)22/h5-10H,3-4H2,1-2H3