Vitas-M small molecule compound
5-nitrospiro[benzimidazole-2,1'-cyclohexane] 1,3-dioxide
Catalog ID
STK837885
SMILES [O-][N+](=O)c1ccc2=[N+](C3([N+](=c2c1)[O-])CCCCC3)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H13N3O4 MW 263.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O4/c16-13-10-5-4-9(15(18)19)8-11(10)14(17)12(13)6-2-1-3-7-12/h4-5,8H,1-3,6-7H2InChIKey
AUYXGRJVKAVYEZ-UHFFFAOYSA-NSynonyms
163126-82-7(O)(N+)(=O)c1ccc2=(N+)(C3((N+)(=c2c1)(O))CCCCC3)(O)
163126827
5NITRO3OXIDANIDYLSPIRO(BENZIMIDAZOL1IUM21CYCLOHEXANE)1OXIDE
5NITRO3OXIDOSPIRO(BENZIMIDAZOL1IUM21CYCLOHEXANE)1OXIDE
5nitrospiro(benzimidazole21cyclohexane)13dioxide
5nitrospiro(benzo(d)imidazole21cyclohexane)13dioxide
5NITROSPIRO(BENZOIMIDAZOLE21CYCLOHEXANE)13DIOXIDE
C1CCC2(CC1)N(C3=C((N+)2=O)C=CC(=C3)(N+)(=O)(O))(O)
InChI=1SC12H13N3O4c161310549(15(18)19)811(10)14(17)12(13)6213712h458H1367H2
MFCD00168424
ZINC000334157070
ZINC19331851
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