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

Systemtic Name: 1-cyclopropyl-7-(4-ethoxycarbonylpiperazin-1-yl)-6-fluoranyl-8-(methoxymethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(4-ethoxycarbonylpiperazin-1-yl)-6-fluoro-8-(methoxymethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(4-ethoxycarbonyl-1-piperazinyl)-6-fluoro-8-(methoxymethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(4-ethoxycarbonylpiperazin-1-yl)-6-fluoro-8-(methoxymethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-carbethoxypiperazino)-1-cyclopropyl-6-fluoro-4-keto-8-(methoxymethyl)quinoline-3-carboxylic acid Formula: C22H26FN3O6 MolecularWeight: 447.456743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C3C(=C2COC)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C3C(=C2COC)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C22H26FN3O6/c1-3-32-22(30)25-8-6-24(7-9-25)19-16(12-31-2)18-14(10-17(19)23)20(27)15(21(28)29)11-26(18)13-4-5-13/h10-11,13H,3-9,12H2,1-2H3,(H,28,29)