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

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-[(propan-2-ylamino)methyl]-3-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-[(isopropylamino)methyl]-4-oxo-3-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-4-oxo-7-[(propan-2-ylamino)methyl]-3-(1-pyrrolidinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-4-oxo-7-[(propan-2-ylamino)methyl]-3-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-7-[(isopropylamino)methyl]-4-keto-3-pyrrolidino-2H-quinoline-3-carboxylic acid Formula: C20H27F2N3O3 MolecularWeight: 395.443486

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(C(=O)C2=CC(=C(C(=C21)F)CNC(C)C)F)(C(=O)O)N3CCCC3

Isomeric SMILES

CCN1CC(C(=O)C2=CC(=C(C(=C21)F)CNC(C)C)F)(C(=O)O)N3CCCC3

InChI

InChI=1S/C20H27F2N3O3/c1-4-24-11-20(19(27)28,25-7-5-6-8-25)18(26)13-9-15(21)14(10-23-12(2)3)16(22)17(13)24/h9,12,23H,4-8,10-11H2,1-3H3,(H,27,28)