Vitas-M small molecule compound

propan-2-yl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK371875
SMILES CC(OC(=O)C1=C(C)NC2=C(C1c1ccc(cc1Cl)Cl)C(=O)CCC2)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 C20H21Cl2NO3 MW 394.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2NO3/c1-10(2)26-20(25)17-11(3)23-15-5-4-6-16(24)19(15)18(17)13-8-7-12(21)9-14(13)22/h7-10,18,23H,4-6H2,1-3H3
InChIKey
GRIDNRKMSBYHQS-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)OC(C)C
InChI=1SC20H21Cl2NO3c110(2)2620(25)1711(3)231554616(24)19(15)18(17)138712(21)914(13)22h7101823H46H213H3
MFCD00619548
propan2yl4(24dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propan2yl4(24dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000019315173
ZINC000019315176

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Available files

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