4-oxidanylidene-7-pyrrolidin-1-yl-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-7-pyrrolidin-1-yl-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid Openeye Name: 4-oxo-7-pyrrolidin-1-yl-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid CAS Name: 4-oxo-7-(1-pyrrolidinyl)-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 4-oxo-7-pyrrolidin-1-yl-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid Traditional Name: 4-keto-7-pyrrolidino-5-(trifluoromethyl)-1H-1,8-naphthyridine-3-carboxylic acid Formula: C14H12F3N3O3 MolecularWeight: 327.25859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)C(=CN3)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)C(=CN3)C(=O)O

InChI

InChI=1S/C14H12F3N3O3/c15-14(16,17)8-5-9(20-3-1-2-4-20)19-12-10(8)11(21)7(6-18-12)13(22)23/h5-6H,1-4H2,(H,22,23)(H,18,19,21)