Vitas-M small molecule compound
ethyl 2-methyl-4-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK087288
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)C)C(=O)CCC2
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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 C20H23NO3 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO3/c1-4-24-20(23)17-13(3)21-15-9-6-10-16(22)19(15)18(17)14-8-5-7-12(2)11-14/h5,7-8,11,18,21H,4,6,9-10H2,1-3H3InChIKey
YYIPVKVHARGEIW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)C)C(=O)CCC2
CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)C)C(=O)CCC2)C
ethyl2methyl4(3methylphenyl)5oxo145678hexahydroquinoline3carboxylate
ethyl2methyl4(3methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC20H23NO3c142420(23)1713(3)2115961016(22)19(15)18(17)1485712(2)1114h578111821H46910H213H3
MFCD02188028
STK087288
ZINC000000436231
ZINC000000436232
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