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Nom: acid ( 1 )

IUPAC: 7-(3-aminopyrrolidin-1-yl)-6-fluoro-1-(4-fluorophenyl)-4-oxoquinoline-3-carboxylic acid

SMILES: NC1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cc2)C1

Canonical SMILES: C1CN(CC1N)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Formule moléculaire: C20H17F2N3O3

Masse molaire: 385.40

InChIKey: LHDJHAUXLFWFHX-UHFFFAOYSA-N

InChI: InChI=1S/C20H17F2N3O3/c21-11-1-3-13(4-2-11)25-10-15(20(27)28)19(26)14-7-16(22)18(8-17(14)25)24-6-5-12(23)9-24/h1-4,7-8,10,12H,5-6,9,23H2,(H,27,28)

PubChem CID: 13500657 →

Synonymes

CHEMBL39249SCHEMBL10530683LHDJHAUXLFWFHX-UHFFFAOYSA-N1-p-fluorophenyl-6-fluoro-1,4-dihydro-4-oxo-7-(3-amino-1-pyrrolidinyl)-quinoline-3-carboxylic acid

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→