1-[(4-ethylphenyl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-ethylphenyl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(3-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(3-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-quinolin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(3-quinolyl)methyl]pipecolinic acid Formula: C24H26N2O2 MolecularWeight: 374.47544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O

InChI

InChI=1S/C24H26N2O2/c1-2-17-10-12-18(13-11-17)23(26-14-6-5-9-22(26)24(27)28)20-15-19-7-3-4-8-21(19)25-16-20/h3-4,7-8,10-13,15-16,22-23H,2,5-6,9,14H2,1H3,(H,27,28)