Vitas-M small molecule compound
(2Z)-2-(4,5-dimethoxy-2-nitrophenyl)-3-(3-nitrophenyl)prop-2-enenitrile
Catalog ID
STL299895
SMILES N#C/C(=C\c1cccc(c1)[N+](=O)[O-])/c1cc(OC)c(cc1[N+](=O)[O-])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 C17H13N3O6 MW 355.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O6/c1-25-16-8-14(15(20(23)24)9-17(16)26-2)12(10-18)6-11-4-3-5-13(7-11)19(21)22/h3-9H,1-2H3/b12-6+InChIKey
HXWSZMJNBCQZNW-WUXMJOGZSA-NSynonyms
299935-45-8(2Z)2(45dimethoxy2nitrophenyl)3(3nitrophenyl)prop2enenitrile
(Z)2(45dimethoxy2nitrophenyl)3(3nitrophenyl)acrylonitrile
(Z)2(45DIMETHOXY2NITROPHENYL)3(3NITROPHENYL)PROP2ENENITRILE
299935458
COC1=C(C=C(C(=C1)C(=CC2=CC(=CC=C2)(N+)(=O)(O))C#N)(N+)(=O)(O))OC
InChI=1SC17H13N3O6c12516814(15(20(23)24)917(16)262)12(1018)61143513(711)19(21)22h39H12H3b126+
MFCD01086083
N#CC(=Cc1cccc(c1)(N+)(=O)(O))c1cc(OC)c(cc1(N+)(=O)(O))OC
ZINC000002274042
ZINC02274042
ZINC2274042
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