7-(3-azanylpyrrolidin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-1-prop-1-en-2-yl-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-1-prop-1-en-2-yl-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-6,8-difluoro-1-isopropenyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-6,8-difluoro-1-(1-methylethenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-6,8-difluoro-4-oxo-1-prop-1-en-2-ylquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-6,8-difluoro-1-isopropenyl-4-keto-quinoline-3-carboxylic acid Formula: C17H17F2N3O3 MolecularWeight: 349.331986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)O

Isomeric SMILES

CC(=C)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)O

InChI

InChI=1S/C17H17F2N3O3/c1-8(2)22-7-11(17(24)25)16(23)10-5-12(18)15(13(19)14(10)22)21-4-3-9(20)6-21/h5,7,9H,1,3-4,6,20H2,2H3,(H,24,25)