Vitas-M small molecule compound
8-bromo-4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid
Catalog ID
STL222864
SMILES COC(=O)c1ccc(cc1)C1Nc2c(C3C1CC=C3)cc(cc2C(=O)O)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 C21H18BrNO4 MW 428.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO4/c1-27-21(26)12-7-5-11(6-8-12)18-15-4-2-3-14(15)16-9-13(22)10-17(20(24)25)19(16)23-18/h2-3,5-10,14-15,18,23H,4H2,1H3,(H,24,25)InChIKey
OGWKMERWSJUXJK-UHFFFAOYSA-NSynonyms
8bromo4(4(methoxycarbonyl)phenyl)3a459btetrahydro3Hcyclopenta(c)quinoline6carboxylicacid
8BROMO4(4METHOXYCARBONYLPHENYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE6CARBOXYLICACID
COC(=O)C1=CC=C(C=C1)C2C3CC=CC3C4=C(N2)C(=CC(=C4)Br)C(=O)O
InChI=1SC21H18BrNO4c12721(26)127511(6812)181542314(15)16913(22)1017(20(24)25)19(16)2318h2351014151823H4H21H3(H2425)
MFCD03763156
ZINC000015226283
ZINC000058928803
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