Vitas-M small molecule compound
4-[(E)-2-(3-chloro-5-ethoxy-4-hydroxyphenyl)-1-cyanoethenyl]benzonitrile
Catalog ID
STK293116
SMILES CCOc1cc(/C=C(\c2ccc(cc2)C#N)/C#N)cc(c1O)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 C18H13ClN2O2 MW 324.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O2/c1-2-23-17-9-13(8-16(19)18(17)22)7-15(11-21)14-5-3-12(10-20)4-6-14/h3-9,22H,2H2,1H3/b15-7-InChIKey
MDQGHKHBRBGQEX-CHHVJCJISA-NSynonyms
4((E)2(3CHLORO5ETHOXY4HYDROXYPHENYL)1CYANOETHENYL)BENZONITRILE
CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C#N)Cl)O
CCOc1cc(C=C(c2ccc(cc2)C#N)C#N)cc(c1O)Cl
InChI=1SC18H13ClN2O2c122317913(816(19)18(17)22)715(1121)145312(1020)4614h3922H2H21H3b157
MFCD05801832
ZINC000000583153
ZINC00583153
ZINC583153
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