5-nitrospiro[2H-indazol-1-ium-1,1'-azinan-1-ium]-3-one chloride

Systemtic Name: 5-nitrospiro[2H-indazol-1-ium-1,1'-azinan-1-ium]-3-one chloride Openeye Name: 5-nitrospiro[2H-indazol-1-ium-1,1'-azinan-1-ium]-3-one chloride CAS Name: 5-nitro-3-spiro[2H-indazol-1-ium-1,1'-azinan-1-ium]one chloride IUPAC Name: 5-nitrospiro[2H-indazol-1-ium-1,1'-azinan-1-ium]-3-one chloride Traditional Name: 5-nitrospiro[2H-indazol-1-ium-1,1'-azinan-1-ium]-3-one chloride Formula: C12H14ClN3O3 MolecularWeight: 283.71086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+]2(CC1)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2.[Cl-]

Isomeric SMILES

C1CC[N+]2(CC1)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2.[Cl-]

InChI

InChI=1S/C12H13N3O3.ClH/c16-12-10-8-9(14(17)18)4-5-11(10)15(13-12)6-2-1-3-7-15;/h4-5,8H,1-3,6-7H2;1H