Vitas-M small molecule compound

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

Catalog ID
STK402446
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OC)C(=O)CC(C2)c1ccccc1

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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 C26H27NO4 MW 417.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO4/c1-4-31-26(29)23-16(2)27-21-14-19(17-9-6-5-7-10-17)15-22(28)25(21)24(23)18-11-8-12-20(13-18)30-3/h5-13,19,24,27H,4,14-15H2,1-3H3
InChIKey
UZQIXMUIIIBAHI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OC)C(=O)CC(C2)C4=CC=CC=C4)C
ethyl4(3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
ethyl4(3methoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC26H27NO4c143126(29)2316(2)27211419(1796571017)1522(28)25(21)24(23)181181220(1318)303h513192427H41415H213H3
MFCD01445579
ZINC000000651886
ZINC000002776209

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Available files

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