Vitas-M small molecule compound
(2E)-2-(1,3-benzodioxol-5-yl)-3-(4-ethoxyphenyl)prop-2-enenitrile
Catalog ID
STK293055
SMILES CCOc1ccc(cc1)/C=C(\c1ccc2c(c1)OCO2)/C#N
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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 C18H15NO3 MW 293.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO3/c1-2-20-16-6-3-13(4-7-16)9-15(11-19)14-5-8-17-18(10-14)22-12-21-17/h3-10H,2,12H2,1H3/b15-9-InChIKey
GSAPKNGZIGSISP-DHDCSXOGSA-NSynonyms
(2E)2(13BENZODIOXOL5YL)3(4ETHOXYPHENYL)PROP2ENENITRILE
(E)2(13BENZODIOXOL5YL)3(4ETHOXYPHENYL)PROP2ENENITRILE
CCOC1=CC=C(C=C1)C=C(C#N)C2=CC3=C(C=C2)OCO3
CCOc1ccc(cc1)C=C(c1ccc2c(c1)OCO2)C#N
InChI=1SC18H15NO3c1220166313(4716)915(1119)14581718(1014)22122117h310H212H21H3b159
MFCD05824420
ZINC000016361257
ZINC16361257
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