Vitas-M small molecule compound
ethyl (4Z)-2-methyl-1-(2-methylpropyl)-4-(4-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK169288
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)[N+](=O)[O-])CC(C)C
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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 C19H22N2O5 MW 358.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O5/c1-5-26-19(23)17-13(4)20(11-12(2)3)18(22)16(17)10-14-6-8-15(9-7-14)21(24)25/h6-10,12H,5,11H2,1-4H3/b16-10-InChIKey
RKFSFEURVGGXFL-YBEGLDIGSA-NSynonyms
(Z)ethyl1isobutyl2methyl4(4nitrobenzylidene)5oxo45dihydro1Hpyrrole3carboxylate
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)(N+)(=O)(O))CC(C)C
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)(N+)(=O)(O))CC(C)C)C
ETHYL(4Z)2METHYL1(2METHYLPROPYL)4((4NITROPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
ETHYL(4Z)2METHYL1(2METHYLPROPYL)4(4NITROBENZYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC19H22N2O5c152619(23)1713(4)20(1112(2)3)18(22)16(17)10146815(9714)21(24)25h61012H511H214H3b1610
MFCD02623654
ZINC000013799951
ZINC13799951
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