Vitas-M small molecule compound
2-[(2-methylphenyl)amino]-2-oxoethyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STL061775
SMILES O=C(Nc1ccccc1C)COC(=O)c1ccc2c(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 C17H15NO5 MW 313.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO5/c1-11-4-2-3-5-13(11)18-16(19)9-21-17(20)12-6-7-14-15(8-12)23-10-22-14/h2-8H,9-10H2,1H3,(H,18,19)InChIKey
VZJYWMHLZJSHTF-UHFFFAOYSA-NSynonyms
(2(2METHYLANILINO)2OXOETHYL)13BENZODIOXOLE5CARBOXYLATE
2((2methylphenyl)amino)2oxoethyl13benzodioxole5carboxylate
CC1=CC=CC=C1NC(=O)COC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC17H15NO5c111423513(11)1816(19)92117(20)12671415(812)23102214h28H910H21H3(H1819)
MFCD05281639
ZINC000003437051
ZINC03437051
ZINC3437051
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