2-(4-ethylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(4-ethylphenyl)quinoline-4-carboxylic acid Openeye Name: 2-(4-ethylphenyl)quinoline-4-carboxylic acid CAS Name: 2-(4-ethylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-ethylphenyl)quinoline-4-carboxylic acid Traditional Name: 2-(4-ethylphenyl)cinchoninic acid Formula: C18H15NO2 MolecularWeight: 277.3172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C18H15NO2/c1-2-12-7-9-13(10-8-12)17-11-15(18(20)21)14-5-3-4-6-16(14)19-17/h3-11H,2H2,1H3,(H,20,21)