Vitas-M small molecule compound

methyl (5E)-2-methyl-4-oxo-5-(3,4,5-trimethoxybenzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STL296465
SMILES COC(=O)C1=C(C)N/C(=C/c2cc(OC)c(c(c2)OC)OC)/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 C17H19NO6 MW 333.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO6/c1-9-14(17(20)24-5)15(19)11(18-9)6-10-7-12(21-2)16(23-4)13(8-10)22-3/h6-8,18H,1-5H3/b11-6+
InChIKey
XYIOEQLJPQJWSK-IZZDOVSWSA-N
Synonyms

(E)methyl2methyl4oxo5(345trimethoxybenzylidene)45dihydro1Hpyrrole3carboxylate
CC1=C(C(=O)C(=CC2=CC(=C(C(=C2)OC)OC)OC)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2cc(OC)c(c(c2)OC)OC)C1=O
InChI=1SC17H19NO6c1914(17(20)245)15(19)11(189)610712(212)16(234)13(810)223h6818H15H3b116+
METHYL(5E)2METHYL4OXO5((345TRIMETHOXYPHENYL)METHYLIDENE)1HPYRROLE3CARBOXYLATE
methyl(5E)2methyl4oxo5(345trimethoxybenzylidene)45dihydro1Hpyrrole3carboxylate
MFCD01829775
ZINC000004094623
ZINC04094623
ZINC4094623

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Available files

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