7-[3-(aminomethyl)pyrrolidin-1-yl]-5,6,8-tris(fluoranyl)-1-(2-fluoranylethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-5,6,8-tris(fluoranyl)-1-(2-fluoranylethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-5,6,8-trifluoro-1-(2-fluoroethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-1-pyrrolidinyl]-5,6,8-trifluoro-1-(2-fluoroethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)pyrrolidin-1-yl]-5,6,8-trifluoro-1-(2-fluoroethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)pyrrolidino]-5,6,8-trifluoro-1-(2-fluoroethyl)-4-keto-quinoline-3-carboxylic acid Formula: C17H17F4N3O3 MolecularWeight: 387.328793

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CN)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3CCF)C(=O)O)F

Isomeric SMILES

C1CN(CC1CN)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3CCF)C(=O)O)F

InChI

InChI=1S/C17H17F4N3O3/c18-2-4-24-7-9(17(26)27)16(25)10-11(19)12(20)15(13(21)14(10)24)23-3-1-8(5-22)6-23/h7-8H,1-6,22H2,(H,26,27)