5-azanyl-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-oxidanyl-pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-oxidanyl-pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-hydroxy-pyrrolidin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-hydroxy-1-pyrrolidinyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-hydroxypyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)-3-hydroxy-pyrrolidino]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H24F2N4O4 MolecularWeight: 422.425766

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1(CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)O

Isomeric SMILES

CN(C)CC1(CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)O

InChI

InChI=1S/C20H24F2N4O4/c1-24(2)8-20(30)5-6-25(9-20)17-13(21)15(23)12-16(14(17)22)26(10-3-4-10)7-11(18(12)27)19(28)29/h7,10,30H,3-6,8-9,23H2,1-2H3,(H,28,29)