sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylate

Systemtic Name: sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylate Openeye Name: sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylate CAS Name: sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]-4-piperidinecarboxylate IUPAC Name: sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylate Traditional Name: sodium 1-[8-(3-fluorophenyl)-1,7-naphthyridin-6-yl]isonipecotate Formula: C20H17FN3NaO2 MolecularWeight: 373.356053

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=CC=C4)F.[Na+]

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=NC(=C3C(=C2)C=CC=N3)C4=CC(=CC=C4)F.[Na+]

InChI

InChI=1S/C20H18FN3O2.Na/c21-16-5-1-3-14(11-16)19-18-15(4-2-8-22-18)12-17(23-19)24-9-6-13(7-10-24)20(25)26;/h1-5,8,11-13H,6-7,9-10H2,(H,25,26);/q;+1/p-1