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

Systemtic Name: 1-[quinolin-4-yl(thiophen-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[4-quinolyl(2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[4-quinolinyl(thiophen-2-yl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[quinolin-4-yl(thiophen-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[4-quinolyl(2-thienyl)methyl]pipecolinic acid Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=NC3=CC=CC=C23)C4=CC=CS4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=NC3=CC=CC=C23)C4=CC=CS4

InChI

InChI=1S/C20H20N2O2S/c23-20(24)17-8-3-4-12-22(17)19(18-9-5-13-25-18)15-10-11-21-16-7-2-1-6-14(15)16/h1-2,5-7,9-11,13,17,19H,3-4,8,12H2,(H,23,24)