6-fluoranyl-1-(3-nitrophenyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(3-nitrophenyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(3-nitrophenyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(3-nitrophenyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(3-nitrophenyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-1-(3-nitrophenyl)-7-piperazino-quinoline-3-carboxylic acid Formula: C20H17FN4O5 MolecularWeight: 412.371183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC(=CC=C4)[N+](=O)[O-])F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC(=CC=C4)[N+](=O)[O-])F

InChI

InChI=1S/C20H17FN4O5/c21-16-9-14-17(10-18(16)23-6-4-22-5-7-23)24(11-15(19(14)26)20(27)28)12-2-1-3-13(8-12)25(29)30/h1-3,8-11,22H,4-7H2,(H,27,28)