Vitas-M small molecule compound

(3aS,4R,9bR)-6-fluoro-4-(4-methoxy-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STL221999
SMILES COc1ccc(cc1[N+](=O)[O-])[C@@H]1Nc2c(F)cccc2[C@H]2[C@@H]1CC=C2

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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 C19H17FN2O3 MW 340.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17FN2O3/c1-25-17-9-8-11(10-16(17)22(23)24)18-13-5-2-4-12(13)14-6-3-7-15(20)19(14)21-18/h2-4,6-10,12-13,18,21H,5H2,1H3/t12-,13+,18+/m1/s1
InChIKey
JLGXPLMOEUEIGL-VBHSOAQHSA-N
Synonyms

(3aS4R9bR)6fluoro4(4methoxy3nitrophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline
COC1=C(C=C(C=C1)C2C3CC=CC3C4=C(N2)C(=CC=C4)F)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))(C@@H)1Nc2c(F)cccc2(C@H)2(C@@H)1CC=C2
InChI=1SC19H17FN2O3c125179811(1016(17)22(23)24)181352412(13)1463715(20)19(14)2118h2461012131821H5H21H3t1213+18+m1s1
MFCD24857545
ZINC000004172090
ZINC04172090
ZINC4172090

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Available files

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