Vitas-M small molecule compound

2-methoxyethyl 4-(2,5-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372303
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)ccc1OC)C(=O)CC(C2)(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 C24H31NO6 MW 429.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO6/c1-14-20(23(27)31-10-9-28-4)21(16-11-15(29-5)7-8-19(16)30-6)22-17(25-14)12-24(2,3)13-18(22)26/h7-8,11,21,25H,9-10,12-13H2,1-6H3
InChIKey
AITIWYSQIMPYEM-UHFFFAOYSA-N
Synonyms

2methoxyethyl4(25dimethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(25dimethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=CC(=C3)OC)OC)C(=O)OCCOC
InChI=1SC24H31NO6c11420(23(27)31109284)21(161115(295)7819(16)306)2217(2514)1224(23)1318(22)26h78112125H9101213H216H3
MFCD00770949
ZINC000002057147
ZINC000002057148

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Available files

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