Vitas-M small molecule compound

2-methylpropyl 4-[4-(methoxycarbonyl)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK003535
SMILES COC(=O)c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC(C)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 C23H27NO5 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5/c1-13(2)12-29-23(27)19-14(3)24-17-6-5-7-18(25)21(17)20(19)15-8-10-16(11-9-15)22(26)28-4/h8-11,13,20,24H,5-7,12H2,1-4H3
InChIKey
JZRPPMITYVXJFA-UHFFFAOYSA-N
Synonyms

2methylpropyl4(4(methoxycarbonyl)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methylpropyl4(4methoxycarbonylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(=O)OC)C(=O)OCC(C)C
COC(=O)c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC(C)C
InChI=1SC23H27NO5c113(2)122923(27)1914(3)241765718(25)21(17)20(19)1581016(11915)22(26)284h811132024H5712H214H3
MFCD02187994
STK003535
ZINC000019772538
ZINC000019772540

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Available files

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