7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-8-chloro-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-8-chloro-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-8-chloro-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-8-chloro-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C16H17ClFN3O3 MolecularWeight: 353.775883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Cl)N3CCC(C3)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Cl)N3CCC(C3)N)F)C(=O)O

InChI

InChI=1S/C16H17ClFN3O3/c1-2-20-7-10(16(23)24)15(22)9-5-11(18)14(12(17)13(9)20)21-4-3-8(19)6-21/h5,7-8H,2-4,6,19H2,1H3,(H,23,24)