Vitas-M small molecule compound

methyl 2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxylate

Catalog ID
STK435946
SMILES COC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)CC(C)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 C21H21NO2 MW 319.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO2/c1-14(2)12-15-8-10-16(11-9-15)20-13-18(21(23)24-3)17-6-4-5-7-19(17)22-20/h4-11,13-14H,12H2,1-3H3
InChIKey
MDHKLVDLNQXSLA-UHFFFAOYSA-N
Synonyms

CC(C)CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC
InChI=1SC21H21NO2c114(2)121581016(11915)201318(21(23)243)17645719(17)2220h4111314H12H213H3
methyl2(4(2methylpropyl)phenyl)quinoline4carboxylate
MFCD03420771
ZINC000001457154
ZINC01457154
ZINC1457154

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.