6-ethyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-ethyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid Openeye Name: 6-ethyl-3-methyl-2-(p-tolyl)quinoline-4-carboxylic acid CAS Name: 6-ethyl-3-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-ethyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 6-ethyl-3-methyl-2-(p-tolyl)cinchoninic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)C)C)C(=O)O

Isomeric SMILES

CCC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)C)C)C(=O)O

InChI

InChI=1S/C20H19NO2/c1-4-14-7-10-17-16(11-14)18(20(22)23)13(3)19(21-17)15-8-5-12(2)6-9-15/h5-11H,4H2,1-3H3,(H,22,23)