7-(3-azanylpyrrolidin-1-yl)-2-ethyl-1,6-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-2-ethyl-1,6-bis(fluoranyl)-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-2-ethyl-1,6-difluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-2-ethyl-1,6-difluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-2-ethyl-1,6-difluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-2-ethyl-1,6-difluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C17H19F2N3O3 MolecularWeight: 351.347866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=C(C(=C(C=C2N1F)N3CCC(C3)N)F)C)C(=O)O

Isomeric SMILES

CCC1=C(C(=O)C2=C(C(=C(C=C2N1F)N3CCC(C3)N)F)C)C(=O)O

InChI

InChI=1S/C17H19F2N3O3/c1-3-10-14(17(24)25)16(23)13-8(2)15(18)12(6-11(13)22(10)19)21-5-4-9(20)7-21/h6,9H,3-5,7,20H2,1-2H3,(H,24,25)