Vitas-M small molecule compound

2-ethoxyethyl 7-(4-methoxyphenyl)-2-methyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK002157
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)c1ccc(cc1)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 C32H33NO5 MW 511.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33NO5/c1-4-37-16-17-38-32(35)29-20(2)33-27-18-23(21-12-14-24(36-3)15-13-21)19-28(34)31(27)30(29)26-11-7-9-22-8-5-6-10-25(22)26/h5-15,23,30,33H,4,16-19H2,1-3H3
InChIKey
XPDOTZOSMMGQHT-UHFFFAOYSA-N
Synonyms
330957-32-9
2ethoxyethyl7(4methoxyphenyl)2methyl4(naphthalen1yl)5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl7(4methoxyphenyl)2methyl4naphthalen1yl5oxo4678tetrahydro1Hquinoline3carboxylate
330957329
CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)c1ccc(cc1)OC
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC=CC4=CC=CC=C43)C(=O)CC(C2)C5=CC=C(C=C5)OC)C
InChI=1SC32H33NO5c143716173832(35)2920(2)33271823(21121424(363)151321)1928(34)31(27)30(29)261179228561025(22)26h515233033H41619H213H3
MFCD01824303
STK002157
ZINC000002927645
ZINC000002927661

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Available files

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