7-[3-(aminomethyl)-4-oxidanyl-piperidin-1-yl]-5-azanyl-6,8-bis(fluoranyl)-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)-4-oxidanyl-piperidin-1-yl]-5-azanyl-6,8-bis(fluoranyl)-1-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-1-piperidyl]-6,8-difluoro-1-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-1-piperidinyl]-6,8-difluoro-1-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[3-(aminomethyl)-4-hydroxypiperidin-1-yl]-6,8-difluoro-1-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-piperidino]-6,8-difluoro-4-keto-1-methyl-quinoline-3-carboxylic acid Formula: C17H20F2N4O4 MolecularWeight: 382.361906

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C(=C(C(=C2N)F)N3CCC(C(C3)CN)O)F)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C(=C(C(=C2N)F)N3CCC(C(C3)CN)O)F)C(=O)O

InChI

InChI=1S/C17H20F2N4O4/c1-22-6-8(17(26)27)16(25)10-13(21)11(18)15(12(19)14(10)22)23-3-2-9(24)7(4-20)5-23/h6-7,9,24H,2-5,20-21H2,1H3,(H,26,27)