Vitas-M small molecule compound
2-[4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-(4-nitrophenyl)acetamide
Catalog ID
STL036427
SMILES COc1ccc(cc1)C1N(CCC2(C1CCCC2)O)CC(=O)Nc1ccc(cc1)[N+](=O)[O-]
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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 C24H29N3O5 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O5/c1-32-20-11-5-17(6-12-20)23-21-4-2-3-13-24(21,29)14-15-26(23)16-22(28)25-18-7-9-19(10-8-18)27(30)31/h5-12,21,23,29H,2-4,13-16H2,1H3,(H,25,28)InChIKey
QZJPUMMCLCPFHZ-UHFFFAOYSA-NSynonyms
1022428-00-71022428007
2(4ahydroxy1(4methoxyphenyl)13456788aoctahydroisoquinolin2yl)N(4nitrophenyl)acetamide
2(4ahydroxy1(4methoxyphenyl)octahydroisoquinolin2(1H)yl)N(4nitrophenyl)acetamide
COC1=CC=C(C=C1)C2C3CCCCC3(CCN2CC(=O)NC4=CC=C(C=C4)(N+)(=O)(O))O
COc1ccc(cc1)C1N(CCC2(C1CCCC2)O)CC(=O)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H29N3O5c1322011517(61220)23214231324(2129)141526(23)1622(28)25187919(10818)27(30)31h512212329H241316H21H3(H2528)
MFCD04193678
ZINC000009209849
ZINC000013786581
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