Vitas-M small molecule compound
(2E)-2-(1,3-benzodioxol-5-yl)-3-(5-chloro-2-ethoxyphenyl)prop-2-enenitrile
Catalog ID
STK293052
SMILES CCOc1ccc(cc1/C=C(\c1ccc2c(c1)OCO2)/C#N)Cl
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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 C18H14ClNO3 MW 327.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClNO3/c1-2-21-16-6-4-15(19)8-13(16)7-14(10-20)12-3-5-17-18(9-12)23-11-22-17/h3-9H,2,11H2,1H3/b14-7-InChIKey
CIOFTNKCLTVKND-AUWJEWJLSA-NSynonyms
(2E)2(13BENZODIOXOL5YL)3(5CHLORO2ETHOXYPHENYL)PROP2ENENITRILE
(E)2(13BENZODIOXOL5YL)3(5CHLORO2ETHOXYPHENYL)PROP2ENENITRILE
CCOC1=C(C=C(C=C1)Cl)C=C(C#N)C2=CC3=C(C=C2)OCO3
CCOc1ccc(cc1C=C(c1ccc2c(c1)OCO2)C#N)Cl
InChI=1SC18H14ClNO3c1221166415(19)813(16)714(1020)12351718(912)23112217h39H211H21H3b147
MFCD05824399
ZINC000016361453
ZINC16361453
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