[(2R)-1-[(2-azanyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-ethyl-azanium

Systemtic Name: [(2R)-1-[(2-azanyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-ethyl-azanium Openeye Name: [(1R)-2-(2-amino-4-fluoro-anilino)-1-methyl-2-oxo-ethyl]-butyl-ethyl-ammonium CAS Name: [(2R)-1-(2-amino-4-fluoroanilino)-1-oxopropan-2-yl]-butyl-ethylammonium IUPAC Name: [(2R)-1-(2-amino-4-fluoroanilino)-1-oxopropan-2-yl]-butyl-ethylazanium Traditional Name: [(1R)-2-(2-amino-4-fluoro-anilino)-2-keto-1-methyl-ethyl]-butyl-ethyl-ammonium Formula: C15H25FN3O+ MolecularWeight: 282.376903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C)C(=O)NC1=C(C=C(C=C1)F)N

Isomeric SMILES

CCCC[NH+](CC)[C@H](C)C(=O)NC1=C(C=C(C=C1)F)N

InChI

InChI=1S/C15H24FN3O/c1-4-6-9-19(5-2)11(3)15(20)18-14-8-7-12(16)10-13(14)17/h7-8,10-11H,4-6,9,17H2,1-3H3,(H,18,20)/p+1/t11-/m1/s1