1-[isoquinolin-6-yl(naphthalen-1-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[isoquinolin-6-yl(naphthalen-1-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[6-isoquinolyl(1-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[6-isoquinolinyl(1-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[isoquinolin-6-yl(naphthalen-1-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[6-isoquinolyl(1-naphthyl)methyl]pipecolinic acid Formula: C26H24N2O2 MolecularWeight: 396.48096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC3=C(C=C2)C=NC=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H24N2O2/c29-26(30)24-10-3-4-15-28(24)25(20-11-12-21-17-27-14-13-19(21)16-20)23-9-5-7-18-6-1-2-8-22(18)23/h1-2,5-9,11-14,16-17,24-25H,3-4,10,15H2,(H,29,30)