Vitas-M small molecule compound

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

Catalog ID
STK372380
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OCCC)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 C23H29NO4 MW 383.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO4/c1-4-13-27-19-12-7-6-9-16(19)21-20(23(26)28-14-5-2)15(3)24-17-10-8-11-18(25)22(17)21/h6-7,9,12,21,24H,4-5,8,10-11,13-14H2,1-3H3
InChIKey
RXFOZMBQUDUXIP-UHFFFAOYSA-N
Synonyms

CCCOC1=CC=CC=C1C2C3=C(CCCC3=O)NC(=C2C(=O)OCCC)C
InChI=1SC23H29NO4c141327191276916(19)2120(23(26)281452)15(3)24171081118(25)22(17)21h679122124H45810111314H213H3
MFCD00717848
propyl2methyl5oxo4(2propoxyphenyl)145678hexahydroquinoline3carboxylate
propyl2methyl5oxo4(2propoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
ZINC000004062253
ZINC000004062259

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Available files

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