Vitas-M small molecule compound
ethyl 4-{3-[(2-bromophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STL173578
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)COc1ccccc1Br)OC)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 C29H32BrNO5 MW 554.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32BrNO5/c1-6-35-28(33)25-17(2)31-21-14-29(3,4)15-22(32)27(21)26(25)18-11-12-23(34-5)19(13-18)16-36-24-10-8-7-9-20(24)30/h7-13,26,31H,6,14-16H2,1-5H3InChIKey
WKNBGAOVJCFZIZ-UHFFFAOYSA-NSynonyms
445031-86-7445031867
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)COC4=CC=CC=C4Br)C(=O)CC(C2)(C)C)C
ethyl4(3((2bromophenoxy)methyl)4methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(3((2bromophenoxy)methyl)4methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC29H32BrNO5c163528(33)2517(2)31211429(34)1522(32)27(21)26(25)18111223(345)19(1318)1636241087920(24)30h7132631H61416H215H3
MFCD02175906
ZINC000002105741
ZINC000002105750
Check stock
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