Vitas-M small molecule compound

(3aS,4R,9bR)-4-(4-methoxy-3-nitrophenyl)-8-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STL222070
SMILES COc1ccc(cc1[N+](=O)[O-])[C@@H]1Nc2ccc(cc2[C@H]2[C@@H]1CC=C2)C

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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/c1-12-6-8-17-16(10-12)14-4-3-5-15(14)20(21-17)13-7-9-19(25-2)18(11-13)22(23)24/h3-4,6-11,14-15,20-21H,5H2,1-2H3/t14-,15+,20+/m1/s1
InChIKey
SKNIDMSHTWWSCS-SIFCLUCFSA-N
Synonyms

(3aS4R9bR)4(4methoxy3nitrophenyl)8methyl3a459btetrahydro3Hcyclopenta(c)quinoline
CC1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))(C@@H)1Nc2ccc(cc2(C@H)2(C@@H)1CC=C2)C
InChI=1SC20H20N2O3c112681716(1012)1443515(14)20(2117)137919(252)18(1113)22(23)24h3461114152021H5H212H3t1415+20+m1s1
MFCD24857612
ZINC000000302477
ZINC00302477
ZINC302477

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Available files

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