7-(3-azanyl-4-methoxy-3-methyl-pyrrolidin-1-yl)-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-4-methoxy-3-methyl-pyrrolidin-1-yl)-6-fluoranyl-1-[(1R,2S)-2-fluoranylcyclopropyl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-4-methoxy-3-methyl-pyrrolidin-1-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-4-methoxy-3-methyl-1-pyrrolidinyl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-4-methoxy-3-methylpyrrolidin-1-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-4-methoxy-3-methyl-pyrrolidino)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C20H23F2N3O4 MolecularWeight: 407.411126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CC(C(C3)(C)N)OC)F)C(=O)C(=CN2C4CC4F)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CC(C(C3)(C)N)OC)F)C(=O)C(=CN2[C@@H]4C[C@@H]4F)C(=O)O

InChI

InChI=1S/C20H23F2N3O4/c1-9-16-10(18(26)11(19(27)28)6-25(16)14-5-12(14)21)4-13(22)17(9)24-7-15(29-3)20(2,23)8-24/h4,6,12,14-15H,5,7-8,23H2,1-3H3,(H,27,28)/t12-,14+,15?,20?/m0/s1