Vitas-M small molecule compound
methyl 4-[(3aS,4R,9bR)-8-fluoro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoate
Catalog ID
STL222055
SMILES COC(=O)c1ccc(cc1)[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)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 C20H18FNO2 MW 323.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FNO2/c1-24-20(23)13-7-5-12(6-8-13)19-16-4-2-3-15(16)17-11-14(21)9-10-18(17)22-19/h2-3,5-11,15-16,19,22H,4H2,1H3/t15-,16+,19+/m1/s1InChIKey
GOECRXXHYNEYRF-GJYPPUQNSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)F
COC(=O)c1ccc(cc1)(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)F
InChI=1SC20H18FNO2c12420(23)137512(6813)191642315(16)171114(21)91018(17)2219h2351115161922H4H21H3t1516+19+m1s1
methyl4((3aS4R9bR)8fluoro3a459btetrahydro3Hcyclopenta(c)quinolin4yl)benzoate
MFCD24857597
ZINC000004111628
ZINC04111628
ZINC4111628
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