Vitas-M small molecule compound
2-phenoxyethyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK035804
SMILES CCOc1cc(cc(c1O)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCOc1ccccc1
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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 C33H31Cl2NO6 MW 608.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31Cl2NO6/c1-3-40-28-18-22(15-25(35)32(28)38)30-29(33(39)42-14-13-41-24-7-5-4-6-8-24)19(2)36-26-16-21(17-27(37)31(26)30)20-9-11-23(34)12-10-20/h4-12,15,18,21,30,36,38H,3,13-14,16-17H2,1-2H3InChIKey
GVQKZXPLGSCPKI-UHFFFAOYSA-NSynonyms
312587-25-02phenoxyethyl4(3chloro5ethoxy4hydroxyphenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(3chloro5ethoxy4hydroxyphenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
312587250
CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OCCOC5=CC=CC=C5)C)Cl)O
CCOc1cc(cc(c1O)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCOc1ccccc1
InChI=1SC33H31Cl2NO6c1340281822(1525(35)32(28)38)3029(33(39)42141341247546824)19(2)36261621(1727(37)31(26)30)2091123(34)121020h412151821303638H313141617H212H3
MFCD01823927
STK035804
ZINC000100559841
ZINC000100559853
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