Vitas-M small molecule compound
methyl 4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK968361
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(o1)COc1ccc(cc1)Br)C(=O)CCC2
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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 C23H22BrNO5 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO5/c1-13-20(23(27)28-2)22(21-17(25-13)4-3-5-18(21)26)19-11-10-16(30-19)12-29-15-8-6-14(24)7-9-15/h6-11,22,25H,3-5,12H2,1-2H3InChIKey
PLAWROOGYFPMPC-UHFFFAOYSA-NSynonyms
445031-48-1445031481
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(O3)COC4=CC=C(C=C4)Br)C(=O)OC
InChI=1SC23H22BrNO5c11320(23(27)282)22(2117(2513)43518(21)26)19111016(3019)1229158614(24)7915h6112225H3512H212H3
methyl4(5((4bromophenoxy)methyl)furan2yl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(5((4bromophenoxy)methyl)furan2yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02175563
ZINC000001002875
ZINC000001002876
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