7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-5-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-5-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-5-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-1-cyclopropyl-5-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C(C=C(C=C32)N4CCC(C4)N)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C(C=C(C=C32)N4CCC(C4)N)F)C(=O)O

InChI

InChI=1S/C17H18FN3O3/c18-13-5-11(20-4-3-9(19)7-20)6-14-15(13)16(22)12(17(23)24)8-21(14)10-1-2-10/h5-6,8-10H,1-4,7,19H2,(H,23,24)