Vitas-M small molecule compound

ethyl 2-methyl-5-oxo-4,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK332465
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccccc1)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 C25H25NO3 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3/c1-3-29-25(28)22-16(2)26-20-14-19(17-10-6-4-7-11-17)15-21(27)24(20)23(22)18-12-8-5-9-13-18/h4-13,19,23,26H,3,14-15H2,1-2H3
InChIKey
IWJLAKGCKMIQHG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3)C(=O)CC(C2)C4=CC=CC=C4)C
ethyl2methyl5oxo47diphenyl145678hexahydroquinoline3carboxylate
ethyl2methyl5oxo47diphenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC25H25NO3c132925(28)2216(2)26201419(17106471117)1521(27)24(20)23(22)18128591318h413192326H31415H212H3
MFCD00614921
ZINC000020068913
ZINC000020068921

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Available files

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