Vitas-M small molecule compound

ethyl (3aS,4R,9bR)-4-[3-(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate

Catalog ID
STK709666
SMILES CCOC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1cccc(c1)C(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 C22H20F3NO2 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3NO2/c1-2-28-21(27)14-9-10-19-18(12-14)16-7-4-8-17(16)20(26-19)13-5-3-6-15(11-13)22(23,24)25/h3-7,9-12,16-17,20,26H,2,8H2,1H3/t16-,17+,20+/m1/s1
InChIKey
ANSKEBAPMGMQFR-UWVAXJGDSA-N
Synonyms

CCOC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC(=CC=C4)C(F)(F)F
CCOC(=O)c1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1cccc(c1)C(F)(F)F
ethyl(3aS4R9bR)4(3(trifluoromethyl)phenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylate
InChI=1SC22H20F3NO2c122821(27)149101918(1214)1674817(16)20(2619)1353615(1113)22(2324)25h3791216172026H28H21H3t1617+20+m1s1
MFCD09992436
ZINC000004757867
ZINC04757867
ZINC4757867

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Available files

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