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

Systemtic Name: 1-[quinolin-2-yl(thiophen-3-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[2-quinolyl(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[2-quinolinyl(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[quinolin-2-yl(thiophen-3-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[2-quinolyl(3-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=CSC=C2)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CSC=C2)C3=NC4=CC=CC=C4C=C3

InChI

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