5-azanyl-7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(1,2-oxazol-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-7-(3-azanylpyrrolidin-1-yl)-6-fluoranyl-1-(1,2-oxazol-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-isoxazol-3-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-(3-amino-1-pyrrolidinyl)-6-fluoro-1-(3-isoxazolyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-(1,2-oxazol-3-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(3-aminopyrrolidino)-6-fluoro-1-isoxazol-3-yl-4-keto-quinoline-3-carboxylic acid Formula: C17H16FN5O4 MolecularWeight: 373.338443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=NOC=C4)N)F

Isomeric SMILES

C1CN(CC1N)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=NOC=C4)N)F

InChI

InChI=1S/C17H16FN5O4/c18-14-11(22-3-1-8(19)6-22)5-10-13(15(14)20)16(24)9(17(25)26)7-23(10)12-2-4-27-21-12/h2,4-5,7-8H,1,3,6,19-20H2,(H,25,26)