Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Catalog ID
STK966498
SMILES O=C(C12CCC(C2(C)C)(C(=O)O1)C)NCc1ccc2c(c1)OCO2
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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 C18H21NO5 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5/c1-16(2)17(3)6-7-18(16,24-15(17)21)14(20)19-9-11-4-5-12-13(8-11)23-10-22-12/h4-5,8H,6-7,9-10H2,1-3H3,(H,19,20)InChIKey
HSASNHNRNGFZFM-UHFFFAOYSA-NSynonyms
618400-55-8(1S4S)N(benzo(d)(13)dioxol5ylmethyl)477trimethyl3oxo2oxabicyclo(221)heptane1carboxamide
618400558
CC1(C2(CCC1(OC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C)C
InChI=1SC18H21NO5c116(2)17(3)6718(162415(17)21)14(20)19911451213(811)23102212h458H67910H213H3(H1920)
MFCD03861491
N(13BENZODIOXOL5YLMETHYL)177TRIMETHYL2OXO3OXABICYCLO(221)HEPTANE4CARBOXAMIDE
N(13benzodioxol5ylmethyl)477trimethyl3oxo2oxabicyclo(221)heptane1carboxamide
N(2HBENZO(34D)13DIOXOLEN5YLMETHYL)(477TRIMETHYL3OXO2OXABICYCLO(221)HEPTYL)CARBOXAMIDE
ZINC000000352793
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