1-(4-cyanonaphthalen-1-yl)piperidine-3-carboxylic acid

Systemtic Name: 1-(4-cyanonaphthalen-1-yl)piperidine-3-carboxylic acid Openeye Name: 1-(4-cyano-1-naphthyl)piperidine-3-carboxylic acid CAS Name: 1-(4-cyano-1-naphthalenyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(4-cyanonaphthalen-1-yl)piperidine-3-carboxylic acid Traditional Name: 1-(4-cyano-1-naphthyl)nipecotic acid Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C3=CC=CC=C32)C#N)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C2=CC=C(C3=CC=CC=C32)C#N)C(=O)O

InChI

InChI=1S/C17H16N2O2/c18-10-12-7-8-16(15-6-2-1-5-14(12)15)19-9-3-4-13(11-19)17(20)21/h1-2,5-8,13H,3-4,9,11H2,(H,20,21)