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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC1CF)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)N

Isomeric SMILES

C[C@]1(CN(C[C@@H]1CF)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)N

InChI

InChI=1S/C20H23F2N3O4/c1-20(23)9-24(7-10(20)6-21)16-14(22)5-12-15(18(16)29-2)25(11-3-4-11)8-13(17(12)26)19(27)28/h5,8,10-11H,3-4,6-7,9,23H2,1-2H3,(H,27,28)/t10-,20+/m0/s1