Vitas-M small molecule compound

2-ethoxyethyl 7-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK402519
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1ccc(cc1)Cl

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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 C29H32ClNO6 MW 526.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3
InChIKey
XFFHRRFIWWOTIR-UHFFFAOYSA-N
Synonyms

2ethoxyethyl7(4chlorophenyl)4(23dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl7(4chlorophenyl)4(23dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)OC)OC)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
InChI=1SC29H32ClNO6c153613143729(33)2517(2)31221519(1891120(30)121018)1623(32)27(22)26(25)2176824(343)28(21)354h612192631H51316H214H3
MFCD01824390
ZINC000002776468
ZINC000002776471

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Available files

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