Vitas-M small molecule compound
1,3-dimethyl-5-[(E)-2-nitroethenyl]-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL387228
SMILES [O-][N+](=O)/C=C/c1ccc2c(c1)n(C)c(=O)n2C
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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 C11H11N3O3 MW 233.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O3/c1-12-9-4-3-8(5-6-14(16)17)7-10(9)13(2)11(12)15/h3-7H,1-2H3/b6-5+InChIKey
CMZDYDPTEGREDP-AATRIKPKSA-NSynonyms
(O)(N+)(=O)C=Cc1ccc2c(c1)n(C)c(=O)n2C
13dimethyl5((E)2nitroethenyl)13dihydro2Hbenzimidazol2one
13DIMETHYL5((E)2NITROETHENYL)BENZIMIDAZOL2ONE
13DIMETHYL5(2NITROVINYL)13DIHYDROBENZOIMIDAZOL2ONE
5((1E)2NITROVINYL)13DIMETHYL3HYDROBENZIMIDAZOL2ONE
CN1C2=C(C=C(C=C2)C=C(N+)(=O)(O))N(C1=O)C
InChI=1SC11H11N3O3c1129438(5614(16)17)710(9)13(2)11(12)15h37H12H3b65+
MFCD00629632
ZINC000000205471
ZINC00205471
ZINC205471
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