7-[4-[2-(2-chloranylphenoxy)ethanoyl]piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[2-(2-chloranylphenoxy)ethanoyl]piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[2-(2-chlorophenoxy)acetyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[2-(2-chlorophenoxy)-1-oxoethyl]-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[2-(2-chlorophenoxy)acetyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[2-(2-chlorophenoxy)acetyl]piperazino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C24H23ClFN3O5 MolecularWeight: 487.907923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)COC4=CC=CC=C4Cl)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)COC4=CC=CC=C4Cl)F)C(=O)O

InChI

InChI=1S/C24H23ClFN3O5/c1-2-27-13-16(24(32)33)23(31)15-11-18(26)20(12-19(15)27)28-7-9-29(10-8-28)22(30)14-34-21-6-4-3-5-17(21)25/h3-6,11-13H,2,7-10,14H2,1H3,(H,32,33)