Vitas-M small molecule compound

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

Catalog ID
STK402281
SMILES CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC

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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 C20H23NO3 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO3/c1-4-13-8-10-14(11-9-13)18-17(20(23)24-3)12(2)21-15-6-5-7-16(22)19(15)18/h8-11,18,21H,4-7H2,1-3H3
InChIKey
QUYKMFZJFSOBCB-UHFFFAOYSA-N
Synonyms
299949-15-8
299949158
CCC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OC)C
InChI=1SC20H23NO3c141381014(11913)1817(20(23)243)12(2)211565716(22)19(15)18h8111821H47H213H3
methyl4(4ethylphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4ethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD00717990
ZINC000000124000
ZINC000000124007

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Available files

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