2-(4-butylphenyl)-8-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-butylphenyl)-8-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-butylphenyl)-8-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(4-butylphenyl)-8-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-butylphenyl)-8-ethylquinoline-4-carboxylic acid Traditional Name: 2-(4-butylphenyl)-8-ethyl-cinchoninic acid Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3CC)C(=C2)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3CC)C(=C2)C(=O)O

InChI

InChI=1S/C22H23NO2/c1-3-5-7-15-10-12-17(13-11-15)20-14-19(22(24)25)18-9-6-8-16(4-2)21(18)23-20/h6,8-14H,3-5,7H2,1-2H3,(H,24,25)