Vitas-M small molecule compound
3-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyanoethenyl]benzonitrile
Catalog ID
STK292962
SMILES N#Cc1cccc(c1)/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 C17H10N2O2 MW 274.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10N2O2/c18-9-13-2-1-3-14(7-13)15(10-19)6-12-4-5-16-17(8-12)21-11-20-16/h1-8H,11H2/b15-6-InChIKey
UQDLPUSAJVFIGQ-UUASQNMZSA-NSynonyms
833439-61-53((1E)2(2HBENZO(34D)13DIOXOLEN5YL)1CYANOVINYL)BENZENECARBONITRILE
3((E)2(13BENZODIOXOL5YL)1CYANOETHENYL)BENZONITRILE
833439615
BENZENEACETONITRILEALPHA(13BENZODIOXOL5YLMETHYLIDENE)3CYANO
C1OC2=C(O1)C=C(C=C2)C=C(C#N)C3=CC=CC(=C3)C#N
InChI=1SC17H10N2O2c1891321314(713)15(1019)612451617(812)21112016h18H11H2b156
MFCD06629756
N#Cc1cccc(c1)C(=Cc1ccc2c(c1)OCO2)C#N
ZINC000004786528
ZINC04786528
ZINC4786528
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