Vitas-M small molecule compound
methyl (4Z)-1-ethyl-2-methyl-4-(3-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL296476
SMILES CCN1C(=O)/C(=C\c2cccc(c2)[N+](=O)[O-])/C(=C1C)C(=O)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 C16H16N2O5 MW 316.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O5/c1-4-17-10(2)14(16(20)23-3)13(15(17)19)9-11-6-5-7-12(8-11)18(21)22/h5-9H,4H2,1-3H3/b13-9-InChIKey
AKXKDEKDMRRLKH-LCYFTJDESA-NSynonyms
(Z)methyl1ethyl2methyl4(3nitrobenzylidene)5oxo45dihydro1Hpyrrole3carboxylate
CCN1C(=C(C(=CC2=CC(=CC=C2)(N+)(=O)(O))C1=O)C(=O)OC)C
CCN1C(=O)C(=Cc2cccc(c2)(N+)(=O)(O))C(=C1C)C(=O)OC
InChI=1SC16H16N2O5c141710(2)14(16(20)233)13(15(17)19)91165712(811)18(21)22h59H4H213H3b139
METHYL(4Z)1ETHYL2METHYL4((3NITROPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
methyl(4Z)1ethyl2methyl4(3nitrobenzylidene)5oxo45dihydro1Hpyrrole3carboxylate
MFCD01893991
ZINC000000441341
ZINC00441341
ZINC441341
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