5-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6-fluoranyl-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6-fluoro-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6-fluoro-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6-fluoro-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6-fluoro-4-keto-8-methyl-7-[7-(methylamino)-5-azaspiro[2.4]heptan-5-yl]quinoline-3-carboxylic acid Formula: C21H25FN4O3 MolecularWeight: 400.446603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CC(C5(C4)CC5)NC

Isomeric SMILES

CC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)N4CC(C5(C4)CC5)NC

InChI

InChI=1S/C21H25FN4O3/c1-10-17-14(19(27)12(20(28)29)7-26(17)11-3-4-11)16(23)15(22)18(10)25-8-13(24-2)21(9-25)5-6-21/h7,11,13,24H,3-6,8-9,23H2,1-2H3,(H,28,29)