Vitas-M small molecule compound

butyl 4-(2,4-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK079595
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1OC)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 C25H33NO5 MW 427.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO5/c1-7-8-11-31-24(28)21-15(2)26-18-13-25(3,4)14-19(27)23(18)22(21)17-10-9-16(29-5)12-20(17)30-6/h9-10,12,22,26H,7-8,11,13-14H2,1-6H3
InChIKey
ZMIMUKAJVURVFX-UHFFFAOYSA-N
Synonyms

butyl4(24dimethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
butyl4(24dimethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1OC)OC)C(=O)CC(C2)(C)C
CCCCOC(=O)C1=C(NC2=C(C1C3=C(C=C(C=C3)OC)OC)C(=O)CC(C2)(C)C)C
InChI=1SC25H33NO5c178113124(28)2115(2)26181325(34)1419(27)23(18)22(21)1710916(295)1220(17)306h910122226H78111314H216H3
MFCD00770932
STK079595
ZINC000002063662
ZINC000002063663

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Available files

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