Vitas-M small molecule compound

propyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK075990
SMILES CCCCOc1ccccc1C1C2=C(CCCC2=O)NC(=C1C(=O)OCCC)C

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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 C24H31NO4 MW 397.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO4/c1-4-6-15-28-20-13-8-7-10-17(20)22-21(24(27)29-14-5-2)16(3)25-18-11-9-12-19(26)23(18)22/h7-8,10,13,22,25H,4-6,9,11-12,14-15H2,1-3H3
InChIKey
DMJCQAHDJXLIBS-UHFFFAOYSA-N
Synonyms

CCCCOC1=CC=CC=C1C2C3=C(CCCC3=O)NC(=C2C(=O)OCCC)C
CCCCOc1ccccc1C1C2=C(CCCC2=O)NC(=C1C(=O)OCCC)C
InChI=1SC24H31NO4c14615282013871017(20)2221(24(27)291452)16(3)25181191219(26)23(18)22h7810132225H46911121415H213H3
MFCD00753320
propyl4(2butoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(2butoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK075990
ZINC000004062266
ZINC000004062273

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.