[4-[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]oxy-3,5-dimethyl-phenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]oxy-3,5-dimethyl-phenyl]methylazanium Openeye Name: [3,5-dimethyl-4-[(1S)-1-methyl-2-oxo-2-ureido-ethoxy]phenyl]methylammonium CAS Name: [4-[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylphenyl]methylazanium Traditional Name: [4-[(1S)-2-keto-1-methyl-2-ureido-ethoxy]-3,5-dimethyl-benzyl]ammonium Formula: C13H20N3O3+ MolecularWeight: 266.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)NC(=O)N)C)C[NH3+]

Isomeric SMILES

CC1=CC(=CC(=C1O[C@@H](C)C(=O)NC(=O)N)C)C[NH3+]

InChI

InChI=1S/C13H19N3O3/c1-7-4-10(6-14)5-8(2)11(7)19-9(3)12(17)16-13(15)18/h4-5,9H,6,14H2,1-3H3,(H3,15,16,17,18)/p+1/t9-/m0/s1