2-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-5,6,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-5,6,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-5,6,8-trifluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-5,6,8-trifluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-5,6,8-trifluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-(3-aminopyrrolidino)-1-cyclopropyl-5,6,8-trifluoro-4-keto-quinoline-3-carboxylic acid Formula: C17H16F3N3O3 MolecularWeight: 367.32245

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C(=C(C=C3F)F)F)C(=O)C(=C2N4CCC(C4)N)C(=O)O

Isomeric SMILES

C1CC1N2C3=C(C(=C(C=C3F)F)F)C(=O)C(=C2N4CCC(C4)N)C(=O)O

InChI

InChI=1S/C17H16F3N3O3/c18-9-5-10(19)14-11(13(9)20)15(24)12(17(25)26)16(23(14)8-1-2-8)22-4-3-7(21)6-22/h5,7-8H,1-4,6,21H2,(H,25,26)