Vitas-M small molecule compound
2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl (4-methylphenoxy)acetate
Catalog ID
STL188368
SMILES O=C(OCC(=O)N1CCOc2c1cc(C)cc2)COc1ccc(cc1)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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-14-3-6-16(7-4-14)25-13-20(23)26-12-19(22)21-9-10-24-18-8-5-15(2)11-17(18)21/h3-8,11H,9-10,12-13H2,1-2H3InChIKey
JNGOSPKEVIBZCD-UHFFFAOYSA-NSynonyms
(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)2(4methylphenoxy)acetate
2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl(4methylphenoxy)acetate
CC1=CC=C(C=C1)OCC(=O)OCC(=O)N2CCOC3=C2C=C(C=C3)C
InChI=1SC20H21NO5c1143616(7414)251320(23)261219(22)2191024188515(2)1117(18)21h3811H9101213H212H3
MFCD22388519
ZINC000072331101
ZINC72331101
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