[2-(4-nitrophenyl)-3-oxidanidyl-1-oxidanyl-benzimidazol-3-ium-5-yl]-thiophen-2-yl-methanone

Systemtic Name: [2-(4-nitrophenyl)-3-oxidanidyl-1-oxidanyl-benzimidazol-3-ium-5-yl]-thiophen-2-yl-methanone Openeye Name: [1-hydroxy-2-(4-nitrophenyl)-3-oxido-benzimidazol-3-ium-5-yl]-(2-thienyl)methanone CAS Name: [1-hydroxy-2-(4-nitrophenyl)-3-oxido-5-benzimidazol-3-iumyl]-thiophen-2-ylmethanone IUPAC Name: [1-hydroxy-2-(4-nitrophenyl)-3-oxidobenzimidazol-3-ium-5-yl]-thiophen-2-ylmethanone Traditional Name: [1-hydroxy-2-(4-nitrophenyl)-3-oxido-benzimidazol-3-ium-5-yl]-(2-thienyl)methanone Formula: C18H11N3O5S MolecularWeight: 381.36204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)C2=CC3=C(C=C2)N(C(=[N+]3[O-])C4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CSC(=C1)C(=O)C2=CC3=C(C=C2)N(C(=[N+]3[O-])C4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C18H11N3O5S/c22-17(16-2-1-9-27-16)12-5-8-14-15(10-12)20(24)18(19(14)23)11-3-6-13(7-4-11)21(25)26/h1-10,23H