N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitro-benzenesulfonamide Openeye Name: N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitro-benzenesulfonamide CAS Name: N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitrobenzenesulfonamide Traditional Name: N-(2-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-nitro-benzenesulfonamide Formula: C21H18ClN3O6S MolecularWeight: 475.90212

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN3O6S/c22-16-5-1-2-6-17(16)24-32(28,29)15-9-10-18(19(11-15)25(26)27)23-12-14-13-30-20-7-3-4-8-21(20)31-14/h1-11,14,23-24H,12-13H2