Vitas-M small molecule compound
2-[(2,4-dimethylphenyl)amino]-2-oxoethyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STL061765
SMILES O=C(Nc1ccc(cc1C)C)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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c1-11-3-5-14(12(2)7-11)19-17(20)9-22-18(21)13-4-6-15-16(8-13)24-10-23-15/h3-8H,9-10H2,1-2H3,(H,19,20)InChIKey
FRDUFSHSMHJFDB-UHFFFAOYSA-NSynonyms
(2(24DIMETHYLANILINO)2OXOETHYL)13BENZODIOXOLE5CARBOXYLATE
2((24dimethylphenyl)amino)2oxoethyl13benzodioxole5carboxylate
CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)OCO3)C
InChI=1SC18H17NO5c1113514(12(2)711)1917(20)92218(21)13461516(813)24102315h38H910H212H3(H1920)
MFCD02716031
ZINC000003216462
ZINC03216462
ZINC3216462
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