6-tert-butyl-2-(4-tert-butylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-tert-butyl-2-(4-tert-butylphenyl)quinoline-4-carboxylic acid Openeye Name: 6-tert-butyl-2-(4-tert-butylphenyl)quinoline-4-carboxylic acid CAS Name: 6-tert-butyl-2-(4-tert-butylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-tert-butyl-2-(4-tert-butylphenyl)quinoline-4-carboxylic acid Traditional Name: 6-tert-butyl-2-(4-tert-butylphenyl)cinchoninic acid Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(C)(C)C)C(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(C)(C)C)C(=C2)C(=O)O

InChI

InChI=1S/C24H27NO2/c1-23(2,3)16-9-7-15(8-10-16)21-14-19(22(26)27)18-13-17(24(4,5)6)11-12-20(18)25-21/h7-14H,1-6H3,(H,26,27)