Vitas-M small molecule compound
5,7-dimethyl-6-oxo-1-(2-oxo-2-phenylethyl)-3-aza-1-azoniatricyclo[3.3.1.1~3,7~]decane
Catalog ID
STL058919
SMILES O=C1C2(C)CN3CC1(C)C[N+](C2)(C3)CC(=O)c1ccccc1
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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 C18H23N2O2 MW 299.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N2O2/c1-17-9-19-10-18(2,16(17)22)12-20(11-17,13-19)8-15(21)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3/q+1InChIKey
MAEAZVALRNSUSH-UHFFFAOYSA-NSynonyms
(1r3s5R7S)57dimethyl6oxo1(2oxo2phenylethyl)13diazaadamantan1iumbromide
57dimethyl6oxo1(2oxo2phenylethyl)3aza1azoniatricyclo(3311~37~)decane
CC12CN3CC(C1=O)(C(N+)(C2)(C3)CC(=O)C4=CC=CC=C4)C
InChI=1SC18H23N2O2c1179191018(216(17)22)1220(11171319)815(21)146435714h37H813H212H3q+1
O=C1C2(C)CN3CC1(C)C(N+)(C2)(C3)CC(=O)c1ccccc1
O=C1C2(C)CN3CC1(C)C(N+)(C2)(C3)CC(=O)c1ccccc1(Br)
ZINC000019312774
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