6-fluoranyl-7-[3-(3-imidazol-1-ylpropylamino)pyrrolidin-1-yl]-4-oxidanylidene-1H-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-[3-(3-imidazol-1-ylpropylamino)pyrrolidin-1-yl]-4-oxidanylidene-1H-1,8-naphthyridine-3-carboxylic acid Openeye Name: 6-fluoro-7-[3-(3-imidazol-1-ylpropylamino)pyrrolidin-1-yl]-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid CAS Name: 6-fluoro-7-[3-[3-(1-imidazolyl)propylamino]-1-pyrrolidinyl]-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 6-fluoro-7-[3-(3-imidazol-1-ylpropylamino)pyrrolidin-1-yl]-4-oxo-1H-1,8-naphthyridine-3-carboxylic acid Traditional Name: 6-fluoro-7-[3-(3-imidazol-1-ylpropylamino)pyrrolidino]-4-keto-1H-1,8-naphthyridine-3-carboxylic acid Formula: C19H21FN6O3 MolecularWeight: 400.406843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NCCCN2C=CN=C2)C3=C(C=C4C(=O)C(=CNC4=N3)C(=O)O)F

Isomeric SMILES

C1CN(CC1NCCCN2C=CN=C2)C3=C(C=C4C(=O)C(=CNC4=N3)C(=O)O)F

InChI

InChI=1S/C19H21FN6O3/c20-15-8-13-16(27)14(19(28)29)9-23-17(13)24-18(15)26-6-2-12(10-26)22-3-1-5-25-7-4-21-11-25/h4,7-9,11-12,22H,1-3,5-6,10H2,(H,28,29)(H,23,24,27)