[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-[(4-methylphenyl)methyl]azanium Openeye Name: [(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]-(p-tolylmethyl)ammonium CAS Name: [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]-[(4-methylphenyl)methyl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]-(4-methylbenzyl)ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]C(C)C(=O)NC(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+][C@@H](C)C(=O)NC(=O)NC

InChI

InChI=1S/C13H19N3O2/c1-9-4-6-11(7-5-9)8-15-10(2)12(17)16-13(18)14-3/h4-7,10,15H,8H2,1-3H3,(H2,14,16,17,18)/p+1/t10-/m0/s1