Vitas-M small molecule compound

methyl 2-({[4-hydroxy-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydroquinolin-3-yl]carbonyl}amino)benzoate

Catalog ID
STK090922
SMILES C=CCn1c(=O)c(C(=O)Nc2ccccc2C(=O)OC)c(c2c1cccc2)O

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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 C21H18N2O5 MW 378.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5/c1-3-12-23-16-11-7-5-9-14(16)18(24)17(20(23)26)19(25)22-15-10-6-4-8-13(15)21(27)28-2/h3-11,24H,1,12H2,2H3,(H,22,25)
InChIKey
HVGRQIZBCMTENH-UHFFFAOYSA-N
Synonyms
327099-69-4
327099694
C=CCn1c(=O)c(C(=O)Nc2ccccc2C(=O)OC)c(c2c1cccc2)O
COC(=O)C1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3N(C2=O)CC=C)O
InChI=1SC21H18N2O5c131223161175914(16)18(24)17(20(23)26)19(25)22151064813(15)21(27)282h31124H112H22H3(H2225)
METHYL2(((4HYDROXY2OXO1(PROP2EN1YL)12DIHYDROQUINOLIN3YL)CARBONYL)AMINO)BENZOATE
METHYL2((2HYDROXY4OXO1PROP2ENYLQUINOLINE3CARBONYL)AMINO)BENZOATE
METHYL2((4HYDROXY2OXO1PROP2ENYL3HYDROQUINOLYL)CARBONYLAMINO)BENZOATE
methyl2((4hydroxy2oxo1prop2enylquinoline3carbonyl)amino)benzoate
methyl2(1allyl4hydroxy2oxo12dihydroquinoline3carboxamido)benzoate
MFCD01046254
STK090922
ZINC000100543105
ZINC100543105

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Available files

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