Vitas-M small molecule compound

propyl 2-{[(2,4-dihydroxy-5,6,7,8-tetrahydroquinolin-3-yl)carbonyl]amino}benzoate

Catalog ID
STL150064
SMILES CCCOC(=O)c1ccccc1NC(=O)c1c(O)nc2c(c1O)CCCC2

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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 C20H22N2O5 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5/c1-2-11-27-20(26)13-8-4-6-10-15(13)22-19(25)16-17(23)12-7-3-5-9-14(12)21-18(16)24/h4,6,8,10H,2-3,5,7,9,11H2,1H3,(H,22,25)(H2,21,23,24)
InChIKey
KXVQQWPUVFBPOI-UHFFFAOYSA-N
Synonyms
497245-74-6
497245746
CCCOC(=O)C1=CC=CC=C1NC(=O)C2=C(C3=C(CCCC3)NC2=O)O
InChI=1SC20H22N2O5c12112720(26)138461015(13)2219(25)1617(23)12735914(12)2118(16)24h46810H2357911H21H3(H2225)(H2212324)
MFCD03806179
propyl2(((24dihydroxy5678tetrahydroquinolin3yl)carbonyl)amino)benzoate
propyl2((4hydroxy2oxo5678tetrahydro1Hquinoline3carbonyl)amino)benzoate
ZINC000009045490
ZINC9045490

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Available files

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