Vitas-M small molecule compound

6-methyl 3-propyl 2,7-dimethyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK404523
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C)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 C24H29NO5 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO5/c1-6-11-30-24(28)19-15(4)25-17-12-14(3)18(23(27)29-5)22(26)21(17)20(19)16-9-7-13(2)8-10-16/h7-10,14,18,20,25H,6,11-12H2,1-5H3
InChIKey
CNGYIJUOEZJSSY-UHFFFAOYSA-N
Synonyms

6methyl3propyl27dimethyl4(4methylphenyl)5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropyl27dimethyl4(4methylphenyl)5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)C)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC24H29NO5c16113024(28)1915(4)25171214(3)18(23(27)295)22(26)21(17)20(19)169713(2)81016h71014182025H61112H215H3
MFCD04226263
ZINC000020561169
ZINC000034853443

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Available files

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