N,N,1-triethyl-4-nitro-benzimidazole-2-sulfonamide

Systemtic Name: N,N,1-triethyl-4-nitro-benzimidazole-2-sulfonamide Openeye Name: N,N,1-triethyl-4-nitro-benzimidazole-2-sulfonamide CAS Name: N,N,1-triethyl-4-nitro-2-benzimidazolesulfonamide IUPAC Name: N,N,1-triethyl-4-nitrobenzimidazole-2-sulfonamide Traditional Name: N,N,1-triethyl-4-nitro-benzimidazole-2-sulfonamide Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC=C2)[N+](=O)[O-])N=C1S(=O)(=O)N(CC)CC

Isomeric SMILES

CCN1C2=C(C(=CC=C2)[N+](=O)[O-])N=C1S(=O)(=O)N(CC)CC

InChI

InChI=1S/C13H18N4O4S/c1-4-15(5-2)22(20,21)13-14-12-10(16(13)6-3)8-7-9-11(12)17(18)19/h7-9H,4-6H2,1-3H3