1-(2-fluoranylcyclopropyl)-8-methoxy-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-fluoranylcyclopropyl)-8-methoxy-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2-fluorocyclopropyl)-8-methoxy-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2-fluorocyclopropyl)-8-methoxy-7-[3-(methoxymethyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2-fluorocyclopropyl)-8-methoxy-7-[3-(methoxymethyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-fluorocyclopropyl)-4-keto-8-methoxy-7-[3-(methoxymethyl)piperazino]quinoline-3-carboxylic acid Formula: C20H24FN3O5 MolecularWeight: 405.420063

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CN(CCN1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4F)C(=O)O)OC

Isomeric SMILES

COCC1CN(CCN1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4F)C(=O)O)OC

InChI

InChI=1S/C20H24FN3O5/c1-28-10-11-8-23(6-5-22-11)15-4-3-12-17(19(15)29-2)24(16-7-14(16)21)9-13(18(12)25)20(26)27/h3-4,9,11,14,16,22H,5-8,10H2,1-2H3,(H,26,27)