Vitas-M small molecule compound
methyl 3-(2H-chromen-3-yl)-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanoate
Catalog ID
STL539722
SMILES COC(=O)CC(c1c(C)[nH]nc1O)C1=Cc2c(OC1)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 C17H18N2O4 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4/c1-10-16(17(21)19-18-10)13(8-15(20)22-2)12-7-11-5-3-4-6-14(11)23-9-12/h3-7,13H,8-9H2,1-2H3,(H2,18,19,21)InChIKey
MPIDFWKIFYAAMX-UHFFFAOYSA-NSynonyms
1435987-92-01435987920
71754916
InChI=1SC17H18N2O4c11016(17(21)191810)13(815(20)222)12711534614(11)23912h3713H89H212H3(H2181921)
methyl3(2~(H)chromen3yl)3(3methyl5oxo12dihydropyrazol4yl)propanoate
methyl3(2Hchromen3yl)3(3hydroxy5methyl1Hpyrazol4yl)propanoate
METHYL3(2HCHROMEN3YL)3(5METHYL3OXO23DIHYDRO1HPYRAZOL4YL)PROPANOATE
MFCD31754913
ZINC000085877634
ZINC000085877637
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