7-(3-azanylpyrrolidin-1-yl)-1-(1-chloranylpropan-2-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-(1-chloranylpropan-2-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-(2-chloro-1-methyl-ethyl)-6,8-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-(1-chloropropan-2-yl)-6,8-difluoro-4-oxo-3-quinolinecarboxylate IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-(1-chloropropan-2-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-(3-aminopyrrolidino)-1-(2-chloro-1-methyl-ethyl)-6,8-difluoro-4-keto-quinoline-3-carboxylate Formula: C17H17ClF2N3O3- MolecularWeight: 384.784986

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCl)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)[O-]

Isomeric SMILES

CC(CCl)N1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)[O-]

InChI

InChI=1S/C17H18ClF2N3O3/c1-8(5-18)23-7-11(17(25)26)16(24)10-4-12(19)15(13(20)14(10)23)22-3-2-9(21)6-22/h4,7-9H,2-3,5-6,21H2,1H3,(H,25,26)/p-1