Vitas-M small molecule compound
5-[(2,6-dimethylphenyl)carbamoyl]-4-methoxy-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Catalog ID
STL552875
SMILES COc1c2OCOc2cc2c1C(C(=O)Nc1c(C)cccc1C)[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 C22H27N2O4 MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4/c1-13-7-6-8-14(2)18(13)23-22(25)19-17-15(9-10-24(19,3)4)11-16-20(21(17)26-5)28-12-27-16/h6-8,11,19H,9-10,12H2,1-5H3/p+1InChIKey
LFEPSMCRVXXJBJ-UHFFFAOYSA-OSynonyms
~(N)(26dimethylphenyl)4methoxy66dimethyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin6ium5carboxamide
4371851
5((26dimethylphenyl)carbamoyl)4methoxy66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6ium
5((26dimethylphenyl)carbamoyl)4methoxy66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6iumiodide
COc1c2OCOc2cc2c1C(C(=O)Nc1c(C)cccc1C)(N+)(CC2)(C)C(I)
InChI=1SC22H26N2O4c11376814(2)18(13)2322(25)191715(91024(193)4)111620(21(17)265)28122716h681119H91012H215H3p+1
N(26DIMETHYLPHENYL)4METHOXY66DIMETHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN6IUM5CARBOXAMIDE
ZINC000002134539
ZINC000002134540
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