7-(4-ethylpiperazin-1-yl)-6,8-bis(fluoranyl)-1-(4-methylphenyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-ethylpiperazin-1-yl)-6,8-bis(fluoranyl)-1-(4-methylphenyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-ethylpiperazin-1-yl)-6,8-difluoro-4-oxo-1-(p-tolyl)quinoline-3-carboxylic acid CAS Name: 7-(4-ethyl-1-piperazinyl)-6,8-difluoro-1-(4-methylphenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-ethylpiperazin-1-yl)-6,8-difluoro-1-(4-methylphenyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-ethylpiperazino)-6,8-difluoro-4-keto-1-(p-tolyl)quinoline-3-carboxylic acid Formula: C23H23F2N3O3 MolecularWeight: 427.443826

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)C)F

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)C)F

InChI

InChI=1S/C23H23F2N3O3/c1-3-26-8-10-27(11-9-26)21-18(24)12-16-20(19(21)25)28(13-17(22(16)29)23(30)31)15-6-4-14(2)5-7-15/h4-7,12-13H,3,8-11H2,1-2H3,(H,30,31)