SpectraBase Spectrum ID |
3jIuhJDmbOP |
Name |
3,4-Bis(carboxymethyl)-6-methyl-2-[(4-methylphenyl)amino]quinoline |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H20N2O4 |
InChI |
InChI=1S/C21H20N2O4/c1-12-3-6-14(7-4-12)22-21-17(11-20(26)27)15(10-19(24)25)16-9-13(2)5-8-18(16)23-21/h3-9H,10-11H2,1-2H3,(H,22,23)(H,24,25)(H,26,27) |
InChIKey |
CFWREPHFAQZTEF-UHFFFAOYSA-N |
Molecular Weight |
364.401 g/mol |
SMILES |
OC(Cc1c2c(nc(c1CC(=O)O)Nc1ccc(cc1)C)ccc(c2)C)=O |
SPLASH |
splash10-03di-0009000000-80dc921f4acf5708834d |
Source of Spectrum |
OV-23-4716-12 |
Synonyms |
[3-(carboxymethyl)-6-methyl-2-(4-toluidino)-4-quinolinyl]acetic acid |
Wiley ID |
1578232 |