6-chloranyl-1-cyclopropyl-8-fluoranyl-4-oxidanylidene-7-(3-oxidanylidenepiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-cyclopropyl-8-fluoranyl-4-oxidanylidene-7-(3-oxidanylidenepiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-cyclopropyl-8-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)quinoline-3-carboxylic acid CAS Name: 6-chloro-1-cyclopropyl-8-fluoro-4-oxo-7-(3-oxo-1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-cyclopropyl-8-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)quinoline-3-carboxylic acid Traditional Name: 6-chloro-1-cyclopropyl-8-fluoro-4-keto-7-(3-ketopiperazino)quinoline-3-carboxylic acid Formula: C17H15ClFN3O4 MolecularWeight: 379.770103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCNC(=O)C4)Cl)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)N4CCNC(=O)C4)Cl)C(=O)O

InChI

InChI=1S/C17H15ClFN3O4/c18-11-5-9-14(13(19)15(11)21-4-3-20-12(23)7-21)22(8-1-2-8)6-10(16(9)24)17(25)26/h5-6,8H,1-4,7H2,(H,20,23)(H,25,26)