Vitas-M small molecule compound

ethyl (3aR,4S,9bS)-4-(2-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate

Catalog ID
STL255137
SMILES CCOC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](N2)c1ccccc1F

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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 C21H20FNO2 MW 337.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FNO2/c1-2-25-21(24)13-10-11-19-17(12-13)14-7-5-8-15(14)20(23-19)16-6-3-4-9-18(16)22/h3-7,9-12,14-15,20,23H,2,8H2,1H3/t14-,15+,20-/m0/s1
InChIKey
JUYCHQWVDSKDAZ-MDOVXXIYSA-N
Synonyms

CCOC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC=CC=C4F
CCOC(=O)c1ccc2c(c1)(C@H)1C=CC(C@H)1(C@H)(N2)c1ccccc1F
ethyl(3aR4S9bS)4(2fluorophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylate
InChI=1SC21H20FNO2c122521(24)1310111917(1213)1475815(14)20(2319)16634918(16)22h3791214152023H28H21H3t1415+20m0s1
MFCD24850192
ZINC000015228892
ZINC15228892

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.