[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl]-[2-(4-fluoroanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [(2R)-1-amino-1-oxopropan-2-yl]-[2-(4-fluoroanilino)-2-oxoethyl]-methylammonium IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl]-[2-(4-fluoroanilino)-2-oxoethyl]-methylazanium Traditional Name: [(1R)-2-amino-2-keto-1-methyl-ethyl]-[2-(4-fluoroanilino)-2-keto-ethyl]-methyl-ammonium Formula: C12H17FN3O2+ MolecularWeight: 254.280683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16FN3O2/c1-8(12(14)18)16(2)7-11(17)15-10-5-3-9(13)4-6-10/h3-6,8H,7H2,1-2H3,(H2,14,18)(H,15,17)/p+1/t8-/m1/s1