1-azanyl-6-fluoranyl-8-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-azanyl-6-fluoranyl-8-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-amino-6-fluoro-8-nitro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-amino-6-fluoro-8-nitro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-amino-6-fluoro-8-nitro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-amino-6-fluoro-4-keto-8-nitro-7-piperazino-quinoline-3-carboxylic acid Formula: C14H14FN5O5 MolecularWeight: 351.289863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2[N+](=O)[O-])N(C=C(C3=O)C(=O)O)N)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2[N+](=O)[O-])N(C=C(C3=O)C(=O)O)N)F

InChI

InChI=1S/C14H14FN5O5/c15-9-5-7-10(19(16)6-8(13(7)21)14(22)23)12(20(24)25)11(9)18-3-1-17-2-4-18/h5-6,17H,1-4,16H2,(H,22,23)