1-ethyl-7-fluoranyl-4-oxidanylidene-8-(3-piperazin-1-ylazetidin-1-yl)benzo[b][1,8]naphthyridine-3-carboxylic acid

Systemtic Name: 1-ethyl-7-fluoranyl-4-oxidanylidene-8-(3-piperazin-1-ylazetidin-1-yl)benzo[b][1,8]naphthyridine-3-carboxylic acid Openeye Name: 1-ethyl-7-fluoro-4-oxo-8-(3-piperazin-1-ylazetidin-1-yl)benzo[b][1,8]naphthyridine-3-carboxylic acid CAS Name: 1-ethyl-7-fluoro-4-oxo-8-[3-(1-piperazinyl)-1-azetidinyl]-3-benzo[b][1,8]naphthyridinecarboxylic acid IUPAC Name: 1-ethyl-7-fluoro-4-oxo-8-(3-piperazin-1-ylazetidin-1-yl)benzo[b][1,8]naphthyridine-3-carboxylic acid Traditional Name: 1-ethyl-7-fluoro-4-keto-8-(3-piperazinoazetidin-1-yl)benzo[b][1,8]naphthyridine-3-carboxylic acid Formula: C22H24FN5O3 MolecularWeight: 425.456063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1N=C3C=C(C(=CC3=C2)F)N4CC(C4)N5CCNCC5)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1N=C3C=C(C(=CC3=C2)F)N4CC(C4)N5CCNCC5)C(=O)O

InChI

InChI=1S/C22H24FN5O3/c1-2-26-12-16(22(30)31)20(29)15-7-13-8-17(23)19(9-18(13)25-21(15)26)28-10-14(11-28)27-5-3-24-4-6-27/h7-9,12,14,24H,2-6,10-11H2,1H3,(H,30,31)