5-fluoranyl-1-(4-fluorophenyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 5-fluoranyl-1-(4-fluorophenyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 5-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 5-fluoro-1-(4-fluorophenyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 5-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 5-fluoro-1-(4-fluorophenyl)-4-keto-7-piperazino-quinoline-3-carboxylic acid Formula: C20H17F2N3O3 MolecularWeight: 385.364086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1)C2=CC(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C20H17F2N3O3/c21-12-1-3-13(4-2-12)25-11-15(20(27)28)19(26)18-16(22)9-14(10-17(18)25)24-7-5-23-6-8-24/h1-4,9-11,23H,5-8H2,(H,27,28)