Vitas-M small molecule compound
benzyl 2-methyl-4-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK089983
SMILES Cc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
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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 C25H25NO3 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3/c1-16-8-6-11-19(14-16)23-22(25(28)29-15-18-9-4-3-5-10-18)17(2)26-20-12-7-13-21(27)24(20)23/h3-6,8-11,14,23,26H,7,12-13,15H2,1-2H3InChIKey
HONGAKGGFNJWQF-UHFFFAOYSA-NSynonyms
347324-55-4347324554
benzyl2methyl4(3methylphenyl)5oxo145678hexahydroquinoline3carboxylate
benzyl2methyl4(3methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=CC=CC(=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4=CC=CC=C4)C
Cc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
InChI=1SC25H25NO3c116861119(1416)2322(25(28)29151894351018)17(2)26201271321(27)24(20)23h36811142326H7121315H212H3
MFCD02188592
STK089983
ZINC000000969340
ZINC000000969341
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