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

Systemtic Name: 7-[3-(aminomethyl)-4-oxidanyl-piperidin-1-yl]-5-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-1-piperidyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-1-piperidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[3-(aminomethyl)-4-hydroxypiperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[3-(aminomethyl)-4-hydroxy-piperidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C20H25FN4O5 MolecularWeight: 420.434703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCC(C(C4)CN)O

Isomeric SMILES

COC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CCC(C(C4)CN)O

InChI

InChI=1S/C20H25FN4O5/c1-30-19-16-13(18(27)11(20(28)29)8-25(16)10-2-3-10)15(23)14(21)17(19)24-5-4-12(26)9(6-22)7-24/h8-10,12,26H,2-7,22-23H2,1H3,(H,28,29)