Vitas-M small molecule compound
1-(2-tert-butoxy-2-oxoethyl)-4-carbamoylpyridinium
Catalog ID
STL059286
SMILES O=C(C[n+]1ccc(cc1)C(=O)N)OC(C)(C)C
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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 C12H17N2O3 MW 237.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O3/c1-12(2,3)17-10(15)8-14-6-4-9(5-7-14)11(13)16/h4-7H,8H2,1-3H3,(H-,13,16)/p+1InChIKey
YUBDHGDFDQOGOJ-UHFFFAOYSA-OSynonyms
1(2(tertbutoxy)2oxoethyl)4carbamoylpyridin1iumchloride
1(2tertbutoxy2oxoethyl)4carbamoylpyridinium
CC(C)(C)OC(=O)C(N+)1=CC=C(C=C1)C(=O)N
InChI=1SC12H16N2O3c112(23)1710(15)814649(5714)11(13)16h47H8H213H3(H1316)p+1
O=C(C(n+)1ccc(cc1)C(=O)N)OC(C)(C)C
O=C(C(n+)1ccc(cc1)C(=O)N)OC(C)(C)C(Cl)
TERTBUTYL2(4CARBAMOYLPYRIDIN1IUM1YL)ACETATE
ZINC000001831543
ZINC01831543
ZINC1831543
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