Vitas-M small molecule compound
(2Z)-2-(3,4-dimethoxyphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-enenitrile
Catalog ID
STK949273
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/c1ccc(c(c1)OC)OC
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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 C21H16N2O5 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O5/c1-26-20-9-5-15(12-21(20)27-2)16(13-22)11-18-8-10-19(28-18)14-3-6-17(7-4-14)23(24)25/h3-12H,1-2H3/b16-11+InChIKey
ISQDGTXWOROQAD-LFIBNONCSA-NSynonyms
(2Z)2(34DIMETHOXYPHENYL)3(5(4NITROPHENYL)(2FURYL))PROP2ENENITRILE
(2Z)2(34dimethoxyphenyl)3(5(4nitrophenyl)furan2yl)prop2enenitrile
(Z)2(34DIMETHOXYPHENYL)3(5(4NITROPHENYL)FURAN2YL)PROP2ENENITRILE
COC1=C(C=C(C=C1)C(=CC2=CC=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C#N)OC
InChI=1SC21H16N2O5c126209515(1221(20)272)16(1322)111881019(2818)143617(7414)23(24)25h312H12H3b1611+
MFCD02634818
N#CC(=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O))c1ccc(c(c1)OC)OC
ZINC000001217419
ZINC01217419
ZINC1217419
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