Vitas-M small molecule compound
methyl (5E)-5-(2,5-dimethoxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160012
SMILES COc1ccc(c(c1)/C=C\1/NC(=C(C1=O)C(=O)OC)C)OC
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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 C16H17NO5 MW 303.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5/c1-9-14(16(19)22-4)15(18)12(17-9)8-10-7-11(20-2)5-6-13(10)21-3/h5-8,17H,1-4H3/b12-8+InChIKey
HNVWIXDWBCNJMR-XYOKQWHBSA-NSynonyms
CC1=C(C(=O)C(=CC2=C(C=CC(=C2)OC)OC)N1)C(=O)OC
COc1ccc(c(c1)C=C1NC(=C(C1=O)C(=O)OC)C)OC
InChI=1SC16H17NO5c1914(16(19)224)15(18)12(179)810711(202)5613(10)213h5817H14H3b128+
METHYL(5E)5((25DIMETHOXYPHENYL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
METHYL(5E)5(25DIMETHOXYBENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01987815
ZINC000004094867
ZINC04094867
ZINC4094867
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