Vitas-M small molecule compound
2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl 3,4-diethoxybenzoate
Catalog ID
STL059686
SMILES CCOc1cc(ccc1OCC)C(=O)OCC(=O)N1CCOc2c1cc(C)cc2
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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 C22H25NO6 MW 399.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO6/c1-4-26-19-9-7-16(13-20(19)27-5-2)22(25)29-14-21(24)23-10-11-28-18-8-6-15(3)12-17(18)23/h6-9,12-13H,4-5,10-11,14H2,1-3H3InChIKey
MYIVLZJAYQAIQG-UHFFFAOYSA-NSynonyms
(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)34diethoxybenzoate
2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl34diethoxybenzoate
CCOC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCOC3=C2C=C(C=C3)C)OCC
InChI=1SC22H25NO6c1426199716(1320(19)2752)22(25)291421(24)23101128188615(3)1217(18)23h691213H45101114H213H3
MFCD18193183
ZINC000057471859
ZINC57471859
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