Vitas-M small molecule compound
methyl 4-(3-chlorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK048474
SMILES COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)C(=O)CC(C2)c1ccc(c(c1)OC)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 C26H26ClNO5 MW 467.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO5/c1-14-23(26(30)33-4)24(16-6-5-7-18(27)10-16)25-19(28-14)11-17(12-20(25)29)15-8-9-21(31-2)22(13-15)32-3/h5-10,13,17,24,28H,11-12H2,1-4H3InChIKey
DTPAUDXAPKTXCT-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=CC(=CC=C4)Cl)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)C(=O)CC(C2)c1ccc(c(c1)OC)OC
InChI=1SC26H26ClNO5c11423(26(30)334)24(1665718(27)1016)2519(2814)1117(1220(25)29)158921(312)22(1315)323h51013172428H1112H214H3
methyl4(3chlorophenyl)7(34dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(3chlorophenyl)7(34dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02224287
STK048474
ZINC000000863520
ZINC000000863523
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