Vitas-M small molecule compound
cyclopentyl 4-(3-chloro-4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STL181667
SMILES COc1ccc(cc1Cl)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCC1
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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 C23H26ClNO4 MW 415.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClNO4/c1-13-20(23(27)29-15-6-3-4-7-15)21(14-10-11-19(28-2)16(24)12-14)22-17(25-13)8-5-9-18(22)26/h10-12,15,21,25H,3-9H2,1-2H3InChIKey
MFRKKFCCNISVQN-UHFFFAOYSA-NSynonyms
938010-18-5938010185
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)Cl)C(=O)OC4CCCC4
cyclopentyl4(3chloro4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(3chloro4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H26ClNO4c11320(23(27)2915634715)21(14101119(282)16(24)1214)2217(2513)85918(22)26h1012152125H39H212H3
MFCD08556658
ZINC000036615157
ZINC000036615158
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