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

Systemtic Name: 5-azanyl-7-[3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[3-(2-aminopropan-2-yl)-1-pyrrolidinyl]-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[3-(1-amino-1-methyl-ethyl)pyrrolidino]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H24F2N4O3 MolecularWeight: 406.426366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)N

Isomeric SMILES

CC(C)(C1CCN(C1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F)N

InChI

InChI=1S/C20H24F2N4O3/c1-20(2,24)9-5-6-25(7-9)17-13(21)15(23)12-16(14(17)22)26(10-3-4-10)8-11(18(12)27)19(28)29/h8-10H,3-7,23-24H2,1-2H3,(H,28,29)