2,5,7-trimethylquinoline-4-carboxylic acid

Systemtic Name: 2,5,7-trimethylquinoline-4-carboxylic acid Openeye Name: 2,5,7-trimethylquinoline-4-carboxylic acid CAS Name: 2,5,7-trimethyl-4-quinolinecarboxylic acid IUPAC Name: 2,5,7-trimethylquinoline-4-carboxylic acid Traditional Name: 2,5,7-trimethylcinchoninic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C)C(=O)O)C

InChI

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