5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-7-[3-methyl-4-(methylamino)piperidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-7-[3-methyl-4-(methylamino)piperidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-(methylamino)-1-piperidyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-(methylamino)-1-piperidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-(methylamino)piperidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-[3-methyl-4-(methylamino)piperidino]quinoline-3-carboxylic acid Formula: C21H27FN4O4 MolecularWeight: 418.461883

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC

Isomeric SMILES

CC1CN(CCC1NC)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC

InChI

InChI=1S/C21H27FN4O4/c1-10-8-25(7-6-13(10)24-2)18-15(22)16(23)14-17(20(18)30-3)26(11-4-5-11)9-12(19(14)27)21(28)29/h9-11,13,24H,4-8,23H2,1-3H3,(H,28,29)