Vitas-M small molecule compound
methyl (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK159999
SMILES COC(=O)C1=C(C)N/C(=C/c2ccc3c(c2)OCO3)/C1=O
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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 C15H13NO5 MW 287.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO5/c1-8-13(15(18)19-2)14(17)10(16-8)5-9-3-4-11-12(6-9)21-7-20-11/h3-6,16H,7H2,1-2H3/b10-5+InChIKey
SAEMUVGNXWTBHW-BJMVGYQFSA-NSynonyms
(E)methyl5(benzo(d)(13)dioxol5ylmethylene)2methyl4oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=O)C(=CC2=CC3=C(C=C2)OCO3)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2ccc3c(c2)OCO3)C1=O
InChI=1SC15H13NO5c1813(15(18)192)14(17)10(168)59341112(69)2172011h3616H7H212H3b105+
METHYL(5E)5(13BENZODIOXOL5YLMETHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
METHYL(5E)5(13BENZODIOXOL5YLMETHYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01829783
ZINC000004095437
ZINC04095437
ZINC4095437
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