Vitas-M small molecule compound
2-phenoxyethyl 7-(4-chlorophenyl)-4-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363592
SMILES COc1cccc(c1)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 C32H30ClNO5 MW 544.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClNO5/c1-20-29(32(36)39-16-15-38-25-8-4-3-5-9-25)30(22-7-6-10-26(17-22)37-2)31-27(34-20)18-23(19-28(31)35)21-11-13-24(33)14-12-21/h3-14,17,23,30,34H,15-16,18-19H2,1-2H3InChIKey
LQZGDJMSXMOPAC-UHFFFAOYSA-NSynonyms
2phenoxyethyl7(4chlorophenyl)4(3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl7(4chlorophenyl)4(3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)OC)C(=O)OCCOC5=CC=CC=C5
InChI=1SC32H30ClNO5c12029(32(36)39161538258435925)30(22761026(1722)372)3127(3420)1823(1928(31)35)21111324(33)141221h31417233034H15161819H212H3
MFCD01445689
ZINC000002776085
ZINC000002776088
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