6-methyl-2-phenyl-3-piperidin-1-yl-quinoline-4-carboxylic acid

Systemtic Name: 6-methyl-2-phenyl-3-piperidin-1-yl-quinoline-4-carboxylic acid Openeye Name: 6-methyl-2-phenyl-3-(1-piperidyl)quinoline-4-carboxylic acid CAS Name: 6-methyl-2-phenyl-3-(1-piperidinyl)-4-quinolinecarboxylic acid IUPAC Name: 6-methyl-2-phenyl-3-piperidin-1-ylquinoline-4-carboxylic acid Traditional Name: 6-methyl-2-phenyl-3-piperidino-cinchoninic acid Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=CC=C3)N4CCCCC4)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=CC=C3)N4CCCCC4)C(=O)O

InChI

InChI=1S/C22H22N2O2/c1-15-10-11-18-17(14-15)19(22(25)26)21(24-12-6-3-7-13-24)20(23-18)16-8-4-2-5-9-16/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3,(H,25,26)