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

Systemtic Name: 5-azanyl-7-[(3R,4R)-3,4-bis(methylamino)pyrrolidin-1-yl]-1-cyclopropyl-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-[(3R,4R)-3,4-bis(methylamino)pyrrolidin-1-yl]-1-cyclopropyl-8-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-[(3R,4R)-3,4-bis(methylamino)-1-pyrrolidinyl]-1-cyclopropyl-8-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-[(3R,4R)-3,4-bis(methylamino)pyrrolidin-1-yl]-1-cyclopropyl-8-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[(3R,4R)-3,4-bis(methylamino)pyrrolidino]-1-cyclopropyl-8-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H24FN5O3 MolecularWeight: 389.423963

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CN(CC1NC)C2=CC(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N

Isomeric SMILES

CN[C@@H]1CN(C[C@H]1NC)C2=CC(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N

InChI

InChI=1S/C19H24FN5O3/c1-22-12-7-24(8-13(12)23-2)14-5-11(21)15-17(16(14)20)25(9-3-4-9)6-10(18(15)26)19(27)28/h5-6,9,12-13,22-23H,3-4,7-8,21H2,1-2H3,(H,27,28)/t12-,13-/m1/s1