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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1(C)N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4F)F

Isomeric SMILES

CC1CN(CC1(C)N)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)[C@@H]4C[C@@H]4F)F

InChI

InChI=1S/C20H23F2N3O4/c1-9-6-24(8-20(9,2)23)16-13(22)4-10-15(18(16)29-3)25(14-5-12(14)21)7-11(17(10)26)19(27)28/h4,7,9,12,14H,5-6,8,23H2,1-3H3,(H,27,28)/t9?,12-,14+,20?/m0/s1