Vitas-M small molecule compound
2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl isoquinoline-1-carboxylate
Catalog ID
STL186991
SMILES COc1cc(ccc1OC)NC(=O)COC(=O)c1nccc2c1cccc2
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-25-16-8-7-14(11-17(16)26-2)22-18(23)12-27-20(24)19-15-6-4-3-5-13(15)9-10-21-19/h3-11H,12H2,1-2H3,(H,22,23)InChIKey
DOYOWUYTTLYWTI-UHFFFAOYSA-NSynonyms
(2(34dimethoxyanilino)2oxoethyl)isoquinoline1carboxylate
2((34dimethoxyphenyl)amino)2oxoethylisoquinoline1carboxylate
COC1=C(C=C(C=C1)NC(=O)COC(=O)C2=NC=CC3=CC=CC=C32)OC
InChI=1SC20H18N2O5c125168714(1117(16)262)2218(23)122720(24)1915643513(15)9102119h311H12H212H3(H2223)
MFCD22387998
ZINC000072330295
ZINC72330295
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