Vitas-M small molecule compound

2-[(2,5-dimethylphenyl)amino]-2-oxoethyl 1,3-benzodioxole-5-carboxylate

Catalog ID
STL061772
SMILES O=C(Nc1cc(C)ccc1C)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/c1-11-3-4-12(2)14(7-11)19-17(20)9-22-18(21)13-5-6-15-16(8-13)24-10-23-15/h3-8H,9-10H2,1-2H3,(H,19,20)
InChIKey
DUZHFEJSFCIURZ-UHFFFAOYSA-N
Synonyms
380162-83-4
(2(25DIMETHYLANILINO)2OXOETHYL)13BENZODIOXOLE5CARBOXYLATE
2((25dimethylphenyl)amino)2oxoethyl13benzodioxole5carboxylate
380162834
CC1=CC(=C(C=C1)C)NC(=O)COC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC18H17NO5c1113412(2)14(711)1917(20)92218(21)13561516(813)24102315h38H910H212H3(H1920)
MFCD02716436
ZINC000003217160
ZINC03217160
ZINC3217160

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Available files

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