Vitas-M small molecule compound
2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]quinolin-8-yl propanoate
Catalog ID
STK521692
SMILES CCC(=O)Oc1cccc2c1nc(/C=C/c1cc3OCOc3cc1Br)cc2
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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 C21H16BrNO4 MW 426.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO4/c1-2-20(24)27-17-5-3-4-13-6-8-15(23-21(13)17)9-7-14-10-18-19(11-16(14)22)26-12-25-18/h3-11H,2,12H2,1H3/b9-7+InChIKey
BZZMPTITEXETGU-VQHVLOKHSA-NSynonyms
(2((E)2(6BROMO13BENZODIOXOL5YL)ETHENYL)QUINOLIN8YL)PROPANOATE
2((E)2(6bromo13benzodioxol5yl)ethenyl)quinolin8ylpropanoate
2(2(6BROMO13BENZODIOXOL5YL)VINYL)8QUINOLINYLPROPIONATE
CCC(=O)OC1=CC=CC2=C1N=C(C=C2)C=CC3=CC4=C(C=C3Br)OCO4
CCC(=O)Oc1cccc2c1nc(C=Cc1cc3OCOc3cc1Br)cc2
InChI=1SC21H16BrNO4c1220(24)2717534136815(2321(13)17)9714101819(1116(14)22)26122518h311H212H21H3b97+
MFCD03271309
ZINC000008397693
ZINC08397693
ZINC8397693
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