Vitas-M small molecule compound
4-methoxybenzyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK060240
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Cl)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 C26H24ClNO6 MW 481.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClNO6/c1-14-23(26(30)32-12-15-6-8-16(31-2)9-7-15)24(25-19(28-14)4-3-5-20(25)29)17-10-21-22(11-18(17)27)34-13-33-21/h6-11,24,28H,3-5,12-13H2,1-2H3InChIKey
DGULTXHEKTXOBO-UHFFFAOYSA-NSynonyms
(4methoxyphenyl)methyl4(6chloro13benzodioxol5yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
4methoxybenzyl4(6chloro13benzodioxol5yl)2methyl5oxo145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3Cl)OCO4)C(=O)OCC5=CC=C(C=C5)OC
COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Cl)C(=O)CCC2
InChI=1SC26H24ClNO6c11423(26(30)3212156816(312)9715)24(2519(2814)43520(25)29)17102122(1118(17)27)34133321h6112428H351213H212H3
MFCD01823672
STK060240
ZINC000000861284
ZINC000000861285
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