Vitas-M small molecule compound
2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl 3,4,5-triethoxybenzoate
Catalog ID
STL013624
SMILES CCOc1cc(cc(c1OCC)OCC)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 C24H29NO7 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO7/c1-5-28-20-13-17(14-21(29-6-2)23(20)30-7-3)24(27)32-15-22(26)25-10-11-31-19-9-8-16(4)12-18(19)25/h8-9,12-14H,5-7,10-11,15H2,1-4H3InChIKey
NXWKNEFVMUIILN-UHFFFAOYSA-NSynonyms
(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)345triethoxybenzoate
2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl345triethoxybenzoate
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)N2CCOC3=C2C=C(C=C3)C
InChI=1SC24H29NO7c1528201317(1421(2962)23(20)3073)24(27)321522(26)25101131199816(4)1218(19)25h891214H57101115H214H3
MFCD18186184
ZINC000051356503
ZINC51356503
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