Vitas-M small molecule compound

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

Catalog ID
STK372569
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OC)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 C25H33NO6 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO6/c1-7-31-10-11-32-24(28)21-15(2)26-17-13-25(3,4)14-18(27)23(17)22(21)16-8-9-19(29-5)20(12-16)30-6/h8-9,12,22,26H,7,10-11,13-14H2,1-6H3
InChIKey
VNJPPLNEBVLCTI-UHFFFAOYSA-N
Synonyms

2ethoxyethyl4(34dimethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl4(34dimethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)OC)C(=O)CC(C2)(C)C)C
InChI=1SC25H33NO6c173110113224(28)2115(2)26171325(34)1418(27)23(17)22(21)168919(295)20(1216)306h89122226H710111314H216H3
MFCD00753164
ZINC000002055273
ZINC000002055274

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Available files

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