(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-methyl-[(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-[(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]-methyl-ammonium Formula: C13H18ClFN3O2+ MolecularWeight: 302.752323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH+](C)CC1=C(C=CC=C1Cl)F

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)[NH+](C)CC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C13H17ClFN3O2/c1-8(12(19)17-13(20)16-2)18(3)7-9-10(14)5-4-6-11(9)15/h4-6,8H,7H2,1-3H3,(H2,16,17,19,20)/p+1/t8-/m1/s1