Vitas-M small molecule compound
methyl 2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372365
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccccc1OC(C)C)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 C21H25NO4 MW 355.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4/c1-12(2)26-17-11-6-5-8-14(17)19-18(21(24)25-4)13(3)22-15-9-7-10-16(23)20(15)19/h5-6,8,11-12,19,22H,7,9-10H2,1-4H3InChIKey
PEIBLUCOYUCRAB-UHFFFAOYSA-NSynonyms
299451-63-1299451631
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3OC(C)C)C(=O)OC
InChI=1SC21H25NO4c112(2)26171165814(17)1918(21(24)254)13(3)2215971016(23)20(15)19h56811121922H7910H214H3
methyl2methyl5oxo4(2(propan2yloxy)phenyl)145678hexahydroquinoline3carboxylate
methyl2methyl5oxo4(2propan2yloxyphenyl)4678tetrahydro1Hquinoline3carboxylate
MFCD00717832
ZINC000000677273
ZINC000000677276
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