2-cyclopropyl-6-fluoranyl-7-[3-(hydroxymethyl)-3-(methylaminomethyl)piperidin-1-yl]-8-methoxy-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-cyclopropyl-6-fluoranyl-7-[3-(hydroxymethyl)-3-(methylaminomethyl)piperidin-1-yl]-8-methoxy-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 2-cyclopropyl-6-fluoro-7-[3-(hydroxymethyl)-3-(methylaminomethyl)-1-piperidyl]-8-methoxy-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 2-cyclopropyl-6-fluoro-7-[3-(hydroxymethyl)-3-(methylaminomethyl)-1-piperidinyl]-8-methoxy-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 2-cyclopropyl-6-fluoro-7-[3-(hydroxymethyl)-3-(methylaminomethyl)piperidin-1-yl]-8-methoxy-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 2-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-[3-(methylaminomethyl)-3-methylol-piperidino]-1H-quinoline-3-carboxylic acid Formula: C22H28FN3O5 MolecularWeight: 433.473223

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1(CCCN(C1)C2=C(C=C3C(=C2OC)NC(=C(C3=O)C(=O)O)C4CC4)F)CO

Isomeric SMILES

CNCC1(CCCN(C1)C2=C(C=C3C(=C2OC)NC(=C(C3=O)C(=O)O)C4CC4)F)CO

InChI

InChI=1S/C22H28FN3O5/c1-24-9-22(11-27)6-3-7-26(10-22)18-14(23)8-13-17(20(18)31-2)25-16(12-4-5-12)15(19(13)28)21(29)30/h8,12,24,27H,3-7,9-11H2,1-2H3,(H,25,28)(H,29,30)