3-butyl-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-butyl-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-butyl-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-butyl-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-butyl-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-butyl-2-phenyl-cinchoninic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H19NO2/c1-2-3-11-16-18(20(22)23)15-12-7-8-13-17(15)21-19(16)14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3,(H,22,23)