5,8-dimethyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 5,8-dimethyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid Openeye Name: 2-(4-isopropylphenyl)-5,8-dimethyl-quinoline-4-carboxylic acid CAS Name: 5,8-dimethyl-2-(4-propan-2-ylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 5,8-dimethyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid Traditional Name: 5,8-dimethyl-2-p-cumenyl-cinchoninic acid Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC=C(C=C3)C(C)C)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC=C(C=C3)C(C)C)C(=O)O

InChI

InChI=1S/C21H21NO2/c1-12(2)15-7-9-16(10-8-15)18-11-17(21(23)24)19-13(3)5-6-14(4)20(19)22-18/h5-12H,1-4H3,(H,23,24)