Vitas-M small molecule compound
2-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]-2-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium
Catalog ID
STL043099
SMILES COc1ccc(cc1F)C(=O)C[N+]1(C)CCc2c(C1)c1ccccc1[nH]2
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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 C21H22FN2O2 MW 353.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN2O2/c1-24(13-20(25)14-7-8-21(26-2)17(22)11-14)10-9-19-16(12-24)15-5-3-4-6-18(15)23-19/h3-8,11,23H,9-10,12-13H2,1-2H3/q+1InChIKey
GOJVNOUQXOSGCF-UHFFFAOYSA-NSynonyms
1(3fluoro4methoxyphenyl)2(2methyl1345tetrahydropyrido(43b)indol2ium2yl)ethanone
2(2(3fluoro4methoxyphenyl)2oxoethyl)2methyl2345tetrahydro1Hpyrido(43b)indol2ium
2(2(3fluoro4methoxyphenyl)2oxoethyl)2methyl2345tetrahydro1Hpyrido(43b)indol2iumbromide
C(N+)1(CCC2=C(C1)C3=CC=CC=C3N2)CC(=O)C4=CC(=C(C=C4)OC)F
COc1ccc(cc1F)C(=O)C(N+)1(C)CCc2c(C1)c1ccccc1(nH)2
COc1ccc(cc1F)C(=O)C(N+)1(C)CCc2c(C1)c1ccccc1(nH)2(Br)
InChI=1SC21H22FN2O2c124(1320(25)147821(262)17(22)1114)1091916(1224)15534618(15)2319h381123H9101213H212H3q+1
ZINC000245246045
ZINC000245246046
ZINC02345405
ZINC2345405
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