7-(2-azanylbutylamino)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(2-azanylbutylamino)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(2-aminobutylamino)-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(2-aminobutylamino)-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(2-aminobutylamino)-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(2-aminobutylamino)-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)N

Isomeric SMILES

CCC(CNC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C3CC3)F)N

InChI

InChI=1S/C17H20FN3O3/c1-2-9(19)7-20-14-6-15-11(5-13(14)18)16(22)12(17(23)24)8-21(15)10-3-4-10/h5-6,8-10,20H,2-4,7,19H2,1H3,(H,23,24)