Vitas-M small molecule compound
methyl 4-(3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK054763
SMILES COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)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 C21H25NO4 MW 355.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4/c1-12-17(20(24)26-5)18(13-7-6-8-14(9-13)25-4)19-15(22-12)10-21(2,3)11-16(19)23/h6-9,18,22H,10-11H2,1-5H3InChIKey
QXYQPFJSSUYOKI-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=CC=C3)OC)C(=O)OC
COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC
InChI=1SC21H25NO4c11217(20(24)265)18(1376814(913)254)1915(2212)1021(23)1116(19)23h691822H1011H215H3
methyl4(3methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(3methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD00717975
STK054763
ZINC000000628428
ZINC000000628435
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Check stock on Vitas-MAvailable files
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