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

Systemtic Name: 6-tert-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid Openeye Name: 6-tert-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid CAS Name: 6-tert-butyl-2-(2-chlorophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-tert-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid Traditional Name: 6-tert-butyl-2-(2-chlorophenyl)cinchoninic acid Formula: C20H18ClNO2 MolecularWeight: 339.81542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H18ClNO2/c1-20(2,3)12-8-9-17-14(10-12)15(19(23)24)11-18(22-17)13-6-4-5-7-16(13)21/h4-11H,1-3H3,(H,23,24)