1-ethyl-6,8-bis(fluoranyl)-7-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-7-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-7-[2-(hydroxymethyl)-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-7-[2-(hydroxymethyl)pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-4-keto-7-(2-methylolpyrrolidino)quinoline-3-carboxylic acid Formula: C17H18F2N2O4 MolecularWeight: 352.332626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCCC3CO)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCCC3CO)F)C(=O)O

InChI

InChI=1S/C17H18F2N2O4/c1-2-20-7-11(17(24)25)16(23)10-6-12(18)15(13(19)14(10)20)21-5-3-4-9(21)8-22/h6-7,9,22H,2-5,8H2,1H3,(H,24,25)