Vitas-M small molecule compound
4-bromophenyl 4-(3,4-dicyanophenoxy)benzoate
Catalog ID
STK389134
SMILES N#Cc1ccc(cc1C#N)Oc1ccc(cc1)C(=O)Oc1ccc(cc1)Br
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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 C21H11BrN2O3 MW 419.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11BrN2O3/c22-17-4-9-19(10-5-17)27-21(25)14-1-6-18(7-2-14)26-20-8-3-15(12-23)16(11-20)13-24/h1-11HInChIKey
LTOQKLUSMKILBJ-UHFFFAOYSA-NSynonyms
(4BROMOPHENYL)4(34DICYANOPHENOXY)BENZOATE
4bromophenyl4(34dicyanophenoxy)benzoate
C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)Br)OC3=CC(=C(C=C3)C#N)C#N
InChI=1SC21H11BrN2O3c22174919(10517)2721(25)141618(7214)26208315(1223)16(1120)1324h111H
MFCD01062984
ZINC000004113445
ZINC04113445
ZINC4113445
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