6-fluoranyl-1-(4-fluorophenyl)-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(4-fluorophenyl)-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(methoxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(4-fluorophenyl)-4-keto-7-[3-(methoxymethyl)piperazino]quinoline-3-carboxylic acid Formula: C22H21F2N3O4 MolecularWeight: 429.416646

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Isomeric SMILES

COCC1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C22H21F2N3O4/c1-31-12-14-10-26(7-6-25-14)20-9-19-16(8-18(20)24)21(28)17(22(29)30)11-27(19)15-4-2-13(23)3-5-15/h2-5,8-9,11,14,25H,6-7,10,12H2,1H3,(H,29,30)