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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)CO)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)CO)F)C(=O)O

InChI

InChI=1S/C17H18F2N2O4/c1-2-20-7-11(17(24)25)16(23)10-5-12(18)15(13(19)14(10)20)21-4-3-9(6-21)8-22/h5,7,9,22H,2-4,6,8H2,1H3,(H,24,25)