Vitas-M small molecule compound
methyl (5E)-2-methyl-4-oxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160777
SMILES C=CCOc1ccc(cc1)/C=C\1/NC(=C(C1=O)C(=O)OC)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 C17H17NO4 MW 299.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4/c1-4-9-22-13-7-5-12(6-8-13)10-14-16(19)15(11(2)18-14)17(20)21-3/h4-8,10,18H,1,9H2,2-3H3/b14-10+InChIKey
FNIKLJXIJKVHOL-GXDHUFHOSA-NSynonyms
1HPYRROLE3CARBOXYLICACID45DIHYDRO2METHYL4OXO5((4(2PROPENYLOXY)PHENYL)METHYLENE)METHYLESTER(9CI)
C=CCOc1ccc(cc1)C=C1NC(=C(C1=O)C(=O)OC)C
CC1=C(C(=O)C(=CC2=CC=C(C=C2)OCC=C)N1)C(=O)OC
InChI=1SC17H17NO4c14922137512(6813)101416(19)15(11(2)1814)17(20)213h481018H19H223H3b1410+
methyl(5E)2methyl4oxo5((4prop2enoxyphenyl)methylidene)1Hpyrrole3carboxylate
METHYL(5E)2METHYL4OXO5(4(PROP2EN1YLOXY)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD04087193
ZINC000003908622
ZINC03908622
ZINC3908622
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