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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxy-2-oxo-ethyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxy-2-oxoethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(2-methoxy-2-oxoethyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-(2-keto-2-methoxy-ethyl)piperazino]quinoline-3-carboxylic acid Formula: C20H22FN3O5 MolecularWeight: 403.404183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

COC(=O)CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H22FN3O5/c1-29-18(25)11-22-4-6-23(7-5-22)17-9-16-13(8-15(17)21)19(26)14(20(27)28)10-24(16)12-2-3-12/h8-10,12H,2-7,11H2,1H3,(H,27,28)