2-(2,4-dimethylphenyl)-3-piperidin-1-yl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2,4-dimethylphenyl)-3-piperidin-1-yl-quinoline-4-carboxylic acid Openeye Name: 2-(2,4-dimethylphenyl)-3-(1-piperidyl)quinoline-4-carboxylic acid CAS Name: 2-(2,4-dimethylphenyl)-3-(1-piperidinyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2,4-dimethylphenyl)-3-piperidin-1-ylquinoline-4-carboxylic acid Traditional Name: 2-(2,4-dimethylphenyl)-3-piperidino-cinchoninic acid Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4CCCCC4)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2N4CCCCC4)C(=O)O)C

InChI

InChI=1S/C23H24N2O2/c1-15-10-11-17(16(2)14-15)21-22(25-12-6-3-7-13-25)20(23(26)27)18-8-4-5-9-19(18)24-21/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H,26,27)