Vitas-M small molecule compound
(3aS,4R,9bR)-4-(2-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STL222011
SMILES COc1ccccc1[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)[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 C19H18N2O3 MW 322.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3/c1-24-18-8-3-2-5-15(18)19-14-7-4-6-13(14)16-11-12(21(22)23)9-10-17(16)20-19/h2-6,8-11,13-14,19-20H,7H2,1H3/t13-,14+,19-/m1/s1InChIKey
YERKLJHNVJXSHB-BIENJYKASA-NSynonyms
(3aS4R9bR)4(2methoxyphenyl)8nitro3a459btetrahydro3Hcyclopenta(c)quinoline
COC1=CC=CC=C1C2C3CC=CC3C4=C(N2)C=CC(=C4)(N+)(=O)(O)
COc1ccccc1(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)(N+)(=O)(O)
InChI=1SC19H18N2O3c12418832515(18)191474613(14)161112(21(22)23)91017(16)2019h2681113141920H7H21H3t1314+19m1s1
MFCD24857555
ZINC000004172140
ZINC04172140
ZINC4172140
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