1-butyl-2-[(5-methyl-2-nitro-phenoxy)methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[(5-methyl-2-nitro-phenoxy)methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(5-methyl-2-nitro-phenoxy)methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[(5-methyl-2-nitrophenoxy)methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(5-methyl-2-nitrophenoxy)methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[(5-methyl-2-nitro-phenoxy)methyl]benzimidazole-5-sulfonamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC3=C(C=CC(=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC3=C(C=CC(=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-3-4-9-22-16-8-6-14(29(20,26)27)11-15(16)21-19(22)12-28-18-10-13(2)5-7-17(18)23(24)25/h5-8,10-11H,3-4,9,12H2,1-2H3,(H2,20,26,27)