Vitas-M small molecule compound
4-[(1E)-2-cyano-3-oxo-3-phenylprop-1-en-1-yl]phenyl 4-methoxybenzoate
Catalog ID
STK083733
SMILES COc1ccc(cc1)C(=O)Oc1ccc(cc1)/C=C(/C(=O)c1ccccc1)\C#N
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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 C24H17NO4 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17NO4/c1-28-21-13-9-19(10-14-21)24(27)29-22-11-7-17(8-12-22)15-20(16-25)23(26)18-5-3-2-4-6-18/h2-15H,1H3/b20-15+InChIKey
GBLZBNPYRRHVEY-HMMYKYKNSA-NSynonyms
(4((E)2CYANO3OXO3PHENYLPROP1ENYL)PHENYL)4METHOXYBENZOATE
4((1E)2CYANO3OXO3PHENYLPROP1EN1YL)PHENYL4METHOXYBENZOATE
COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)C3=CC=CC=C3
COc1ccc(cc1)C(=O)Oc1ccc(cc1)C=C(C(=O)c1ccccc1)C#N
InChI=1SC24H17NO4c1282113919(101421)24(27)292211717(81222)1520(1625)23(26)185324618h215H1H3b2015+
MFCD03062831
STK083733
ZINC000004672330
ZINC04672330
ZINC4672330
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