Vitas-M small molecule compound
4-{5-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]furan-2-yl}-3-methylbenzoic acid
Catalog ID
STK201411
SMILES N#C/C(=C/c1ccc(o1)c1ccc(cc1C)C(=O)O)/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/c1-13-10-15(21(24)25)4-8-19(13)20-9-7-18(28-20)11-16(12-22)14-2-5-17(6-3-14)23(26)27/h2-11H,1H3,(H,24,25)/b16-11-InChIKey
RYEPDVMNRVSNSW-WJDWOHSUSA-NSynonyms
4(5((E)2CYANO2(4NITROPHENYL)ETHENYL)FURAN2YL)3METHYLBENZOICACID
CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC21H14N2O5c1131015(21(24)25)4819(13)209718(2820)1116(1222)142517(6314)23(26)27h211H1H3(H2425)b1611
MFCD04336433
N#CC(=Cc1ccc(o1)c1ccc(cc1C)C(=O)O)c1ccc(cc1)(N+)(=O)(O)
ZINC000012393000
ZINC12393000
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