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

Systemtic Name: 2-(4-heptylphenyl)quinoline-4-carboxylic acid Openeye Name: 2-(4-heptylphenyl)quinoline-4-carboxylic acid CAS Name: 2-(4-heptylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-heptylphenyl)quinoline-4-carboxylic acid Traditional Name: 2-(4-heptylphenyl)cinchoninic acid Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C23H25NO2/c1-2-3-4-5-6-9-17-12-14-18(15-13-17)22-16-20(23(25)26)19-10-7-8-11-21(19)24-22/h7-8,10-16H,2-6,9H2,1H3,(H,25,26)