2-ethyl-3-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-ethyl-3-methyl-quinoline-4-carboxylic acid Openeye Name: 2-ethyl-3-methyl-quinoline-4-carboxylic acid CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-ethyl-3-methylquinoline-4-carboxylic acid Traditional Name: 2-ethyl-3-methyl-cinchoninic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O

InChI

InChI=1S/C13H13NO2/c1-3-10-8(2)12(13(15)16)9-6-4-5-7-11(9)14-10/h4-7H,3H2,1-2H3,(H,15,16)