4-[4-(5,6-dimethylbenzimidazol-1-yl)-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-(5,6-dimethylbenzimidazol-1-yl)-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-(5,6-dimethylbenzimidazol-1-yl)-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-(5,6-dimethyl-1-benzimidazolyl)-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-(5,6-dimethylbenzimidazol-1-yl)-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-(5,6-dimethylbenzimidazol-1-yl)-3-nitro-phenyl]sulfonylmorpholine Formula: C19H20N4O5S MolecularWeight: 416.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S/c1-13-9-16-18(10-14(13)2)22(12-20-16)17-4-3-15(11-19(17)23(24)25)29(26,27)21-5-7-28-8-6-21/h3-4,9-12H,5-8H2,1-2H3