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

Systemtic Name: 1-(3-cyanoquinolin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(3-cyano-4-quinolyl)piperidine-4-carboxylic acid CAS Name: 1-(3-cyano-4-quinolinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(3-cyanoquinolin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(3-cyano-4-quinolyl)isonipecotic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C=NC3=CC=CC=C32)C#N

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C=NC3=CC=CC=C32)C#N

InChI

InChI=1S/C16H15N3O2/c17-9-12-10-18-14-4-2-1-3-13(14)15(12)19-7-5-11(6-8-19)16(20)21/h1-4,10-11H,5-8H2,(H,20,21)