3-(dimethylamino)-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 3-(dimethylamino)-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid Openeye Name: 3-(dimethylamino)-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid CAS Name: 3-(dimethylamino)-2-(2,4-dimethylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 3-(dimethylamino)-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid Traditional Name: 3-(dimethylamino)-2-(2,4-dimethylphenyl)cinchoninic acid Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2N(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2N(C)C)C(=O)O)C

InChI

InChI=1S/C20H20N2O2/c1-12-9-10-14(13(2)11-12)18-19(22(3)4)17(20(23)24)15-7-5-6-8-16(15)21-18/h5-11H,1-4H3,(H,23,24)