Vitas-M small molecule compound
(2E)-3-(5-chloro-2-methoxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK201495
SMILES N#C/C(=C/c1cc(Cl)ccc1OC)/c1cccc(c1)[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 C16H11ClN2O3 MW 314.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O3/c1-22-16-6-5-14(17)8-12(16)7-13(10-18)11-3-2-4-15(9-11)19(20)21/h2-9H,1H3/b13-7-InChIKey
GDDSUZVPAWVXCR-QPEQYQDCSA-NSynonyms
(2E)3(5CHLORO2METHOXYPHENYL)2(3NITROPHENYL)PROP2ENENITRILE
(E)3(5CHLORO2METHOXYPHENYL)2(3NITROPHENYL)PROP2ENENITRILE
COC1=C(C=C(C=C1)Cl)C=C(C#N)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC16H11ClN2O3c122166514(17)812(16)713(1018)1132415(911)19(20)21h29H1H3b137
MFCD05997825
N#CC(=Cc1cc(Cl)ccc1OC)c1cccc(c1)(N+)(=O)(O)
ZINC000012393034
ZINC12393034
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