Vitas-M small molecule compound
methyl N-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]carbonyl}-beta-alaninate
Catalog ID
STL319588
SMILES COCCn1cc(C(=O)NCCC(=O)OC)c2c(c1=O)cccc2
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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 C17H20N2O5 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O5/c1-23-10-9-19-11-14(16(21)18-8-7-15(20)24-2)12-5-3-4-6-13(12)17(19)22/h3-6,11H,7-10H2,1-2H3,(H,18,21)InChIKey
TZJMPQBLAAEADL-UHFFFAOYSA-NSynonyms
1574464-83-71574464837
COCCN1C=C(C2=CC=CC=C2C1=O)C(=O)NCCC(=O)OC
InChI=1SC17H20N2O5c123109191114(16(21)188715(20)242)12534613(12)17(19)22h3611H710H212H3(H1821)
methyl3((2(2methoxyethyl)1oxoisoquinoline4carbonyl)amino)propanoate
methyl3(2(2methoxyethyl)1oxo12dihydroisoquinoline4carboxamido)propanoate
methylN((2(2methoxyethyl)1oxo12dihydroisoquinolin4yl)carbonyl)betaalaninate
MFCD28031953
ZINC000095480184
ZINC95480184
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