Vitas-M small molecule compound
4-methoxy-5-[(4-methoxyphenyl)carbamoyl]-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Catalog ID
STL552960
SMILES COc1c2OCOc2cc2c1C(C(=O)Nc1ccc(cc1)OC)[N+](CC2)(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 C21H25N2O5 MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5/c1-23(2)10-9-13-11-16-19(28-12-27-16)20(26-4)17(13)18(23)21(24)22-14-5-7-15(25-3)8-6-14/h5-8,11,18H,9-10,12H2,1-4H3/p+1InChIKey
XQBVKQBPRQINMH-UHFFFAOYSA-OSynonyms
3695188
4methoxy~(N)(4methoxyphenyl)66dimethyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin6ium5carboxamide
4methoxy5((4methoxyphenyl)carbamoyl)66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6ium
4methoxy5((4methoxyphenyl)carbamoyl)66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6iumiodide
4METHOXYN(4METHOXYPHENYL)66DIMETHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN6IUM5CARBOXAMIDE
COc1c2OCOc2cc2c1C(C(=O)Nc1ccc(cc1)OC)(N+)(CC2)(C)C(I)
InChI=1SC21H24N2O5c123(2)10913111619(28122716)20(264)17(13)18(23)21(24)22145715(253)8614h581118H91012H214H3p+1
ZINC000001834248
ZINC000001834249
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