1-[[1-[(4-fluorophenyl)methyl]-2-oxidanylidene-1,8-naphthyridin-3-yl]carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[1-[(4-fluorophenyl)methyl]-2-oxidanylidene-1,8-naphthyridin-3-yl]carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carbonyl]piperidine-4-carboxylic acid CAS Name: 1-[[1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridin-3-yl]-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-[(4-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carbonyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(4-fluorobenzyl)-2-keto-1,8-naphthyridine-3-carbonyl]isonipecotic acid Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(N=CC=C3)N(C2=O)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(N=CC=C3)N(C2=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O4/c23-17-5-3-14(4-6-17)13-26-19-16(2-1-9-24-19)12-18(21(26)28)20(27)25-10-7-15(8-11-25)22(29)30/h1-6,9,12,15H,7-8,10-11,13H2,(H,29,30)