6,8-bis(fluoranyl)-7-imidazolidin-1-yl-1-(3-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6,8-bis(fluoranyl)-7-imidazolidin-1-yl-1-(3-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(1-carboxy-2-methyl-butyl)-6,8-difluoro-7-imidazolidin-1-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6,8-difluoro-1-(1-hydroxy-3-methyl-1-oxopentan-2-yl)-7-(1-imidazolidinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6,8-difluoro-1-(1-hydroxy-3-methyl-1-oxopentan-2-yl)-7-imidazolidin-1-yl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(1-carboxy-2-methyl-butyl)-6,8-difluoro-7-imidazolidin-1-yl-4-keto-quinoline-3-carboxylic acid Formula: C19H21F2N3O5 MolecularWeight: 409.383946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCNC3)F)C(=O)O

Isomeric SMILES

CCC(C)C(C(=O)O)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCNC3)F)C(=O)O

InChI

InChI=1S/C19H21F2N3O5/c1-3-9(2)14(19(28)29)24-7-11(18(26)27)17(25)10-6-12(20)16(13(21)15(10)24)23-5-4-22-8-23/h6-7,9,14,22H,3-5,8H2,1-2H3,(H,26,27)(H,28,29)