3-(3,5-dimethylpyrazol-1-yl)-2-(4-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-2-(4-methylphenyl)quinoline-4-carboxylic acid Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-2-(p-tolyl)quinoline-4-carboxylic acid CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-2-(4-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-2-(4-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-2-(p-tolyl)cinchoninic acid Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4C(=CC(=N4)C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4C(=CC(=N4)C)C)C(=O)O

InChI

InChI=1S/C22H19N3O2/c1-13-8-10-16(11-9-13)20-21(25-15(3)12-14(2)24-25)19(22(26)27)17-6-4-5-7-18(17)23-20/h4-12H,1-3H3,(H,26,27)