Vitas-M small molecule compound
(2E)-3-(2-butoxy-5-chlorophenyl)-2-phenylprop-2-enenitrile
Catalog ID
STL495414
SMILES CCCCOc1ccc(cc1/C=C(\c1ccccc1)/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 C19H18ClNO MW 311.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClNO/c1-2-3-11-22-19-10-9-18(20)13-16(19)12-17(14-21)15-7-5-4-6-8-15/h4-10,12-13H,2-3,11H2,1H3/b17-12-InChIKey
DSKVDWJAOQGKES-ATVHPVEESA-NSynonyms
(2E)3(2butoxy5chlorophenyl)2phenylprop2enenitrile
(E)3(2BUTOXY5CHLOROPHENYL)2PHENYLPROP2ENENITRILE
CCCCOC1=C(C=C(C=C1)Cl)C=C(C#N)C2=CC=CC=C2
CCCCOc1ccc(cc1C=C(c1ccccc1)C#N)Cl
InChI=1SC19H18ClNOc12311221910918(20)1316(19)1217(1421)157546815h4101213H2311H21H3b1712
MFCD30716754
ZINC000033390819
ZINC33390819
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