Vitas-M small molecule compound
6-methyl 3-propyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404440
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1cc(Cl)c(c(c1)OCC)O)C(=O)C(C(C2)C)C(=O)OC
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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 C25H30ClNO7 MW 491.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30ClNO7/c1-6-8-34-25(31)19-13(4)27-16-9-12(3)18(24(30)32-5)23(29)21(16)20(19)14-10-15(26)22(28)17(11-14)33-7-2/h10-12,18,20,27-28H,6-9H2,1-5H3InChIKey
ZCBANYVKKBWWQY-UHFFFAOYSA-NSynonyms
6methyl3propyl4(3chloro5ethoxy4hydroxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropyl4(3chloro5ethoxy4hydroxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)Cl)O)OCC)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC25H30ClNO7c1683425(31)1913(4)2716912(3)18(24(30)325)23(29)21(16)20(19)141015(26)22(28)17(1114)3372h101218202728H69H215H3
MFCD04226216
ZINC000020560996
ZINC000033732587
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