7-(3-azanyl-4-methoxy-pyrrolidin-1-yl)-1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-4-methoxy-pyrrolidin-1-yl)-1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-4-methoxy-pyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-4-methoxy-1-pyrrolidinyl)-1-(2,4-difluorophenyl)-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-4-methoxypyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-4-methoxy-pyrrolidino)-1-(2,4-difluorophenyl)-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H20F3N3O5 MolecularWeight: 463.40651

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC1N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)F)F)F

Isomeric SMILES

COC1CN(CC1N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)F)F)F

InChI

InChI=1S/C22H20F3N3O5/c1-32-17-9-27(8-15(17)26)19-14(25)6-11-18(21(19)33-2)28(7-12(20(11)29)22(30)31)16-4-3-10(23)5-13(16)24/h3-7,15,17H,8-9,26H2,1-2H3,(H,30,31)