8-chloranyl-6-fluoranyl-4-oxidanylidene-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-6-fluoranyl-4-oxidanylidene-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6-fluoro-4-oxo-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 8-chloro-6-fluoro-4-oxo-1-phenyl-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-6-fluoro-4-oxo-1-phenyl-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 8-chloro-6-fluoro-4-keto-1-phenyl-7-piperazino-quinoline-3-carboxylic acid Formula: C20H17ClFN3O3 MolecularWeight: 401.818683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

InChI

InChI=1S/C20H17ClFN3O3/c21-16-17-13(10-15(22)18(16)24-8-6-23-7-9-24)19(26)14(20(27)28)11-25(17)12-4-2-1-3-5-12/h1-5,10-11,23H,6-9H2,(H,27,28)