Vitas-M small molecule compound
(3aS,4R,9bR)-4-[2-(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
Catalog ID
STL221972
SMILES OC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccccc1C(F)(F)F
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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 C20H16F3NO2 MW 359.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3NO2/c21-20(22,23)16-7-2-1-4-14(16)18-13-6-3-5-12(13)15-10-11(19(25)26)8-9-17(15)24-18/h1-5,7-10,12-13,18,24H,6H2,(H,25,26)/t12-,13+,18-/m1/s1InChIKey
RRCBSKUUIZVMFI-FHSNZYRGSA-NSynonyms
(3aS4R9bR)4(2(trifluoromethyl)phenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylicacid
C1C=CC2C1C(NC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4C(F)(F)F
InChI=1SC20H16F3NO2c2120(2223)16721414(16)181363512(13)151011(19(25)26)8917(15)2418h1571012131824H6H2(H2526)t1213+18m1s1
MFCD09992435
OC(=O)c1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1ccccc1C(F)(F)F
ZINC000005244587
ZINC5244587
Check stock
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