(5E)-5-(nitrosomethylidene)-1-oxidanidyl-3-oxidanyl-spiro[benzimidazol-1-ium-2,1'-cyclopentane]

Systemtic Name: (5E)-5-(nitrosomethylidene)-1-oxidanidyl-3-oxidanyl-spiro[benzimidazol-1-ium-2,1'-cyclopentane] Openeye Name: (5E)-3-hydroxy-5-(nitrosomethylene)-1-oxido-spiro[benzimidazol-1-ium-2,1'-cyclopentane] CAS Name: (5E)-3-hydroxy-5-(nitrosomethylidene)-1-oxidospiro[benzimidazol-1-ium-2,1'-cyclopentane] IUPAC Name: (5E)-3-hydroxy-5-(nitrosomethylidene)-1-oxidospiro[benzimidazol-1-ium-2,1'-cyclopentane] Traditional Name: (5E)-3-hydroxy-5-(nitrosomethylene)-1-oxido-spiro[benzimidazol-1-ium-2,1'-cyclopentane] Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)N(C3=CC(=CN=O)C=CC3=[N+]2[O-])O

Isomeric SMILES

C1CCC2(C1)N(C3=C/C(=C/N=O)/C=CC3=[N+]2[O-])O

InChI

InChI=1S/C12H13N3O3/c16-13-8-9-3-4-10-11(7-9)15(18)12(14(10)17)5-1-2-6-12/h3-4,7-8,18H,1-2,5-6H2/b9-8+