Vitas-M small molecule compound
(3aS,4R,9bR)-4-(4-methoxy-3-nitrophenyl)-6-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STL222066
SMILES COc1ccc(cc1[N+](=O)[O-])[C@@H]1Nc2c(C)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 C20H20N2O3 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3/c1-12-5-3-7-15-14-6-4-8-16(14)20(21-19(12)15)13-9-10-18(25-2)17(11-13)22(23)24/h3-7,9-11,14,16,20-21H,8H2,1-2H3/t14-,16-,20-/m0/s1InChIKey
XDFSRIBCWBUTOS-UVFQYZLESA-NSynonyms
(3aS4R9bR)4(4methoxy3nitrophenyl)6methyl3a459btetrahydro3Hcyclopenta(c)quinoline
CC1=CC=CC2=C1NC(C3C2C=CC3)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))(C@@H)1Nc2c(C)cccc2(C@H)2(C@@H)1CC=C2
InChI=1SC20H20N2O3c112537151464816(14)20(2119(12)15)1391018(252)17(1113)22(23)24h3791114162021H8H212H3t141620m0s1
MFCD24857608
ZINC000014165844
ZINC14165844
Check stock
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Check stock on Vitas-MAvailable files
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