935-12-6 Purity
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Specification
The molecular formula is C14H15NO3.
The synonyms are:
93514-84-2
ethyl 4-hydroxy-5,7-dimethylquinoline-3-carboxylate
4-Hydroxy-5,7-dimethyl-quinoline-3-carboxylic acid ethyl ester
ethyl 5,7-dimethyl-4-oxo-1H-quinoline-3-carboxylate
5,7-DIMETHYL-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER
The molecular weight is 245.27 g/mol.
The IUPAC name is ethyl 5,7-dimethyl-4-oxo-1H-quinoline-3-carboxylate.
The InChI is InChI=1S/C14H15NO3/c1-4-18-14(17)10-7-15-11-6-8(2)5-9(3)12(11)13(10)16/h5-7H,4H2,1-3H3,(H,15,16).
The InChIKey is OQQHMUNGHJABQY-UHFFFAOYSA-N.
The Canonical SMILES is CCOC(=O)C1=CNC2=CC(=CC(=C2C1=O)C)C.
The CAS number is 93514-84-2.
Yes, it is a canonicalized compound.