Vitas-M small molecule compound
2-phenoxyethyl 4-(2,3-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407231
SMILES O=C(C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CC(C2)(C)C)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 C27H27Cl2NO4 MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27Cl2NO4/c1-16-22(26(32)34-13-12-33-17-8-5-4-6-9-17)23(18-10-7-11-19(28)25(18)29)24-20(30-16)14-27(2,3)15-21(24)31/h4-11,23,30H,12-15H2,1-3H3InChIKey
RRMSKOXYEPJOJF-UHFFFAOYSA-NSynonyms
313244-55-22phenoxyethyl4(23dichlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(23dichlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
313244552
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C(=CC=C3)Cl)Cl)C(=O)OCCOC4=CC=CC=C4
InChI=1SC27H27Cl2NO4c11622(26(32)34131233178546917)23(181071119(28)25(18)29)2420(3016)1427(23)1521(24)31h4112330H1215H213H3
MFCD01367224
ZINC000002083553
ZINC000002083554
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