Vitas-M small molecule compound
methyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK048990
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-10-15(18(22)23-2)16(11-6-8-12(20)9-7-11)17-13(19-10)4-3-5-14(17)21/h6-9,16,19-20H,3-5H2,1-2H3InChIKey
MLKHRTXBNBJMTP-UHFFFAOYSA-NSynonyms
299451-66-4299451664
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)O)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CCC2
InChI=1SC18H19NO4c11015(18(22)232)16(116812(20)9711)1713(1910)43514(17)21h69161920H35H212H3
methyl4(4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD00638708
STK048990
ZINC000019639238
ZINC000019639243
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