7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(4-fluorophenyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(4-fluorophenyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-(4-fluorophenyl)-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-6-fluoro-1-(4-fluorophenyl)-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-(4-fluorophenyl)-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-6-fluoro-1-(4-fluorophenyl)-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C21H19F2N3O3 MolecularWeight: 399.390666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1F)N3CCC(C3)N)N(C=C(C2=O)C(=O)O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C2C(=CC(=C1F)N3CCC(C3)N)N(C=C(C2=O)C(=O)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H19F2N3O3/c1-11-18-16(8-17(19(11)23)25-7-6-13(24)9-25)26(10-15(20(18)27)21(28)29)14-4-2-12(22)3-5-14/h2-5,8,10,13H,6-7,9,24H2,1H3,(H,28,29)