7,8-dimethyl-3-oxidanyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 7,8-dimethyl-3-oxidanyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid Openeye Name: 3-hydroxy-2-(4-isopropylphenyl)-7,8-dimethyl-quinoline-4-carboxylic acid CAS Name: 3-hydroxy-7,8-dimethyl-2-(4-propan-2-ylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 3-hydroxy-7,8-dimethyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylic acid Traditional Name: 3-hydroxy-7,8-dimethyl-2-p-cumenyl-cinchoninic acid Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)O)C3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)O)C3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C21H21NO3/c1-11(2)14-6-8-15(9-7-14)19-20(23)17(21(24)25)16-10-5-12(3)13(4)18(16)22-19/h5-11,23H,1-4H3,(H,24,25)