Vitas-M small molecule compound

2-methoxyethyl 4-[4-(methoxycarbonyl)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372557
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C(=O)OC)C(=O)CC(C2)(C)C

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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 C24H29NO6 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO6/c1-14-19(23(28)31-11-10-29-4)20(15-6-8-16(9-7-15)22(27)30-5)21-17(25-14)12-24(2,3)13-18(21)26/h6-9,20,25H,10-13H2,1-5H3
InChIKey
ZFCPJDRDHQPZSO-UHFFFAOYSA-N
Synonyms

2methoxyethyl4(4(methoxycarbonyl)phenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(4methoxycarbonylphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)C(=O)OC)C(=O)OCCOC
InChI=1SC24H29NO6c11419(23(28)311110294)20(156816(9715)22(27)305)2117(2514)1224(23)1318(21)26h692025H1013H215H3
MFCD00753121
ZINC000003094401
ZINC000003094402

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Available files

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