1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoranyl-4-oxidanylidene-8-prop-1-en-2-yl-quinoline-2-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoranyl-4-oxidanylidene-8-prop-1-en-2-yl-quinoline-2-carboxylic acid Openeye Name: 1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoro-8-isopropenyl-4-oxo-quinoline-2-carboxylic acid CAS Name: 1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoro-8-(1-methylethenyl)-4-oxo-2-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoro-4-oxo-8-prop-1-en-2-ylquinoline-2-carboxylic acid Traditional Name: 1-cyclopropyl-7-(2,5-diazabicyclo[2.2.1]heptan-4-yl)-6-fluoro-8-isopropenyl-4-keto-quinaldic acid Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=C2C(=CC(=C1C34CC(CN3)NC4)F)C(=O)C=C(N2C5CC5)C(=O)O

Isomeric SMILES

CC(=C)C1=C2C(=CC(=C1C34CC(CN3)NC4)F)C(=O)C=C(N2C5CC5)C(=O)O

InChI

InChI=1S/C21H22FN3O3/c1-10(2)17-18(21-7-11(8-24-21)23-9-21)14(22)5-13-16(26)6-15(20(27)28)25(19(13)17)12-3-4-12/h5-6,11-12,23-24H,1,3-4,7-9H2,2H3,(H,27,28)