Vitas-M small molecule compound
7,7-dimethyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-2-carboxylic acid
Catalog ID
STL090262
SMILES Cc1ccc(cc1)C1C=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)O
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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 C19H21NO3 MW 311.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO3/c1-11-4-6-12(7-5-11)13-8-14(18(22)23)20-15-9-19(2,3)10-16(21)17(13)15/h4-8,13,20H,9-10H2,1-3H3,(H,22,23)InChIKey
GWDJQUQXYZSAMW-UHFFFAOYSA-NSynonyms
77dimethyl4(4methylphenyl)5oxo145678hexahydroquinoline2carboxylicacid
77dimethyl4(4methylphenyl)5oxo1468tetrahydroquinoline2carboxylicacid
CC1=CC=C(C=C1)C2C=C(NC3=C2C(=O)CC(C3)(C)C)C(=O)O
InChI=1SC19H21NO3c1114612(7511)13814(18(22)23)2015919(23)1016(21)17(13)15h481320H910H213H3(H2223)
MFCD09463011
ZINC000102411717
ZINC000102411720
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