1-[8-(3-chloranyl-4-fluoranyl-phenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[8-(3-chloranyl-4-fluoranyl-phenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid Openeye Name: 1-[8-(3-chloro-4-fluoro-phenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid CAS Name: 1-[8-(3-chloro-4-fluorophenyl)-1,7-naphthyridin-6-yl]-4-piperidinecarboxylic acid IUPAC Name: 1-[8-(3-chloro-4-fluorophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid Traditional Name: 1-[8-(3-chloro-4-fluoro-phenyl)-1,7-naphthyridin-6-yl]isonipecotic acid Formula: C20H17ClFN3O2 MolecularWeight: 385.819283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H17ClFN3O2/c21-15-10-14(3-4-16(15)22)19-18-13(2-1-7-23-18)11-17(24-19)25-8-5-12(6-9-25)20(26)27/h1-4,7,10-12H,5-6,8-9H2,(H,26,27)