Vitas-M small molecule compound

methyl (4Z)-4-(2,3-dimethoxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK698663
SMILES COC(=O)C1=C(C)NC(=O)/C/1=C\c1cccc(c1OC)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/c1-9-13(16(19)22-4)11(15(18)17-9)8-10-6-5-7-12(20-2)14(10)21-3/h5-8H,1-4H3,(H,17,18)/b11-8-
InChIKey
WTDMCNXHWZDIAL-FLIBITNWSA-N
Synonyms

(Z)methyl4(23dimethoxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=CC2=C(C(=CC=C2)OC)OC)C(=O)N1)C(=O)OC
COC(=O)C1=C(C)NC(=O)C1=Cc1cccc(c1OC)OC
InChI=1SC16H17NO5c1913(16(19)224)11(15(18)179)81065712(202)14(10)213h58H14H3(H1718)b118
METHYL(4Z)4((23DIMETHOXYPHENYL)METHYLIDENE)2METHYL5OXO1HPYRROLE3CARBOXYLATE
methyl(4Z)4(23dimethoxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
MFCD00685940
ZINC000000068620
ZINC00068620
ZINC68620

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Available files

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