Vitas-M small molecule compound

3-ethyl 6-methyl 2,7-dimethyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK407500
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)C(C(C2)C)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 C26H27NO5 MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO5/c1-5-32-26(30)21-15(3)27-19-13-14(2)20(25(29)31-4)24(28)23(19)22(21)18-12-8-10-16-9-6-7-11-17(16)18/h6-12,14,20,22,27H,5,13H2,1-4H3
InChIKey
MJDRNAFGILWDRT-UHFFFAOYSA-N
Synonyms

3ethyl6methyl27dimethyl4(naphthalen1yl)5oxo145678hexahydroquinoline36dicarboxylate
3Oethyl6Omethyl27dimethyl4naphthalen1yl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC(=O)C1=C(NC2=C(C1C3=CC=CC4=CC=CC=C43)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC26H27NO5c153226(30)2115(3)27191314(2)20(25(29)314)24(28)23(19)22(21)1812810169671117(16)18h61214202227H513H214H3
MFCD04057149
ZINC000000816150
ZINC000033936416

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Available files

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