Vitas-M small molecule compound
(3aS,4R,9bR)-4-(3-methoxyphenyl)-8,9-dimethyl-6-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STL222098
SMILES COc1cccc(c1)[C@@H]1Nc2c(cc(c(c2[C@H]2[C@@H]1CC=C2)C)C)[N+](=O)[O-]
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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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-12-10-18(23(24)25)21-19(13(12)2)16-8-5-9-17(16)20(22-21)14-6-4-7-15(11-14)26-3/h4-8,10-11,16-17,20,22H,9H2,1-3H3/t16-,17+,20+/m1/s1InChIKey
PIUMFLSONQOYLG-UWVAXJGDSA-NSynonyms
(3aS4R9bR)4(3methoxyphenyl)89dimethyl6nitro3a459btetrahydro3Hcyclopenta(c)quinoline
CC1=CC(=C2C(=C1C)C3C=CCC3C(N2)C4=CC(=CC=C4)OC)(N+)(=O)(O)
COc1cccc(c1)(C@@H)1Nc2c(cc(c(c2(C@H)2(C@@H)1CC=C2)C)C)(N+)(=O)(O)
InChI=1SC21H22N2O3c1121018(23(24)25)2119(13(12)2)1685917(16)20(2221)1464715(1114)263h48101116172022H9H213H3t1617+20+m1s1
MFCD24857638
ZINC000004151411
ZINC04151411
ZINC4151411
Check stock
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