7-[2-(aminomethyl)morpholin-4-yl]-6,8-bis(fluoranyl)-1-(2-fluoranylethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[2-(aminomethyl)morpholin-4-yl]-6,8-bis(fluoranyl)-1-(2-fluoranylethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[2-(aminomethyl)morpholin-4-yl]-6,8-difluoro-1-(2-fluoroethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[2-(aminomethyl)-4-morpholinyl]-6,8-difluoro-1-(2-fluoroethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[2-(aminomethyl)morpholin-4-yl]-6,8-difluoro-1-(2-fluoroethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-(aminomethyl)morpholino]-6,8-difluoro-1-(2-fluoroethyl)-4-keto-quinoline-3-carboxylic acid Formula: C17H18F3N3O4 MolecularWeight: 385.33773

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CCF)F)CN

Isomeric SMILES

C1COC(CN1C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CCF)F)CN

InChI

InChI=1S/C17H18F3N3O4/c18-1-2-22-8-11(17(25)26)16(24)10-5-12(19)15(13(20)14(10)22)23-3-4-27-9(6-21)7-23/h5,8-9H,1-4,6-7,21H2,(H,25,26)