Vitas-M small molecule compound
methyl 2-{5-[(Z)-2-cyano-2-(4-nitrophenyl)ethenyl]furan-2-yl}benzoate
Catalog ID
STK083448
SMILES N#C/C(=C\c1ccc(o1)c1ccccc1C(=O)OC)/c1ccc(cc1)[N+](=O)[O-]
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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 C21H14N2O5 MW 374.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O5/c1-27-21(24)19-5-3-2-4-18(19)20-11-10-17(28-20)12-15(13-22)14-6-8-16(9-7-14)23(25)26/h2-12H,1H3/b15-12+InChIKey
AKAMUFQJKCUUKM-NTCAYCPXSA-NSynonyms
COC(=O)C1=CC=CC=C1C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC21H14N2O5c12721(24)19532418(19)20111017(2820)1215(1322)146816(9714)23(25)26h212H1H3b1512+
METHYL2(5((Z)2CYANO2(4NITROPHENYL)ETHENYL)FURAN2YL)BENZOATE
MFCD02187768
N#CC(=Cc1ccc(o1)c1ccccc1C(=O)OC)c1ccc(cc1)(N+)(=O)(O)
STK083448
ZINC000013893565
ZINC13893565
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