Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl 4-cyanobenzoate
Catalog ID
STL059816
SMILES N#Cc1ccc(cc1)C(=O)OCC(=O)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 C18H14N2O5 MW 338.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O5/c19-8-12-1-4-14(5-2-12)18(22)23-10-17(21)20-9-13-3-6-15-16(7-13)25-11-24-15/h1-7H,9-11H2,(H,20,21)InChIKey
PPQXJGIEDCQLCM-UHFFFAOYSA-NSynonyms
386281-03-4(2(13BENZODIOXOL5YLMETHYLAMINO)2OXOETHYL)4CYANOBENZOATE
2((13benzodioxol5ylmethyl)amino)2oxoethyl4cyanobenzoate
386281034
C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=CC=C(C=C3)C#N
InChI=1SC18H14N2O5c198121414(5212)18(22)231017(21)20913361516(713)25112415h17H911H2(H2021)
MFCD03978155
ZINC000003315549
ZINC03315549
ZINC3315549
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