Vitas-M small molecule compound
4-methoxybenzyl 4-[4-(dimethylamino)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363575
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
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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 C29H34N2O4 MW 474.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O4/c1-18-25(28(33)35-17-19-7-13-22(34-6)14-8-19)26(20-9-11-21(12-10-20)31(4)5)27-23(30-18)15-29(2,3)16-24(27)32/h7-14,26,30H,15-17H2,1-6H3InChIKey
CMGSEXFGMREMJR-UHFFFAOYSA-NSynonyms
(4methoxyphenyl)methyl4(4(dimethylamino)phenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
4methoxybenzyl4(4(dimethylamino)phenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)N(C)C)C(=O)OCC4=CC=C(C=C4)OC
InChI=1SC29H34N2O4c11825(28(33)35171971322(346)14819)26(2091121(121020)31(4)5)2723(3018)1529(23)1624(27)32h7142630H1517H216H3
MFCD01445649
ZINC000000666777
ZINC000002776345
Check stock
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Check stock on Vitas-MAvailable files
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