7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-1-cyclopropyl-8-ethynyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H18FN3O3 MolecularWeight: 355.362923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

C#CC1=C2C(=CC(=C1N3CCC(C3)N)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C19H18FN3O3/c1-2-12-16-13(7-15(20)17(12)22-6-5-10(21)8-22)18(24)14(19(25)26)9-23(16)11-3-4-11/h1,7,9-11H,3-6,8,21H2,(H,25,26)