3-(4-fluoranylphenoxy)propyl-methyl-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 3-(4-fluoranylphenoxy)propyl-methyl-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 3-(4-fluorophenoxy)propyl-methyl-[(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: 3-(4-fluorophenoxy)propyl-methyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: 3-(4-fluorophenoxy)propyl-methyl-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]azanium Traditional Name: 3-(4-fluorophenoxy)propyl-[(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]-methyl-ammonium Formula: C15H23FN3O3+ MolecularWeight: 312.359823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH+](C)CCCOC1=CC=C(C=C1)F

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)[NH+](C)CCCOC1=CC=C(C=C1)F

InChI

InChI=1S/C15H22FN3O3/c1-11(14(20)18-15(21)17-2)19(3)9-4-10-22-13-7-5-12(16)6-8-13/h5-8,11H,4,9-10H2,1-3H3,(H2,17,18,20,21)/p+1/t11-/m0/s1