Vitas-M small molecule compound
2-(4-hydroxy-3-methoxyphenyl)-1,3-dimethyl-1H-3,1-benzimidazol-3-ium
Catalog ID
STL147011
SMILES COc1cc(ccc1O)c1n(C)c2c([n+]1C)cccc2
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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 C16H17N2O2 MW 269.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O2/c1-17-12-6-4-5-7-13(12)18(2)16(17)11-8-9-14(19)15(10-11)20-3/h4-10H,1-3H3/p+1InChIKey
IFQXIZJEJIIFQP-UHFFFAOYSA-OSynonyms
2(4hydroxy3methoxyphenyl)13dimethyl1H31benzimidazol3ium
2(4hydroxy3methoxyphenyl)13dimethyl1Hbenzo(d)imidazol3iumchloride
4(13DIMETHYLBENZIMIDAZOL3IUM2YL)2METHOXYPHENOL
CN1C2=CC=CC=C2(N+)(=C1C3=CC(=C(C=C3)O)OC)C
COc1cc(ccc1O)c1n(C)c2c((n+)1C)cccc2
COc1cc(ccc1O)c1n(C)c2c((n+)1C)cccc2(Cl)
InChI=1SC16H16N2O2c11712645713(12)18(2)16(17)118914(19)15(1011)203h410H13H3p+1
MFCD00630101
ZINC000334157125
ZINC225690
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