[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]-[2-(4-bromanylphenoxy)ethyl]-methyl-azanium

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]-[2-(4-bromanylphenoxy)ethyl]-methyl-azanium Openeye Name: 2-(4-bromophenoxy)ethyl-methyl-[(1R)-1-methyl-2-oxo-2-ureido-ethyl]ammonium CAS Name: 2-(4-bromophenoxy)ethyl-[(2R)-1-(carbamoylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-[(2R)-1-(carbamoylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: 2-(4-bromophenoxy)ethyl-[(1R)-2-keto-1-methyl-2-ureido-ethyl]-methyl-ammonium Formula: C13H19BrN3O3+ MolecularWeight: 345.21226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)[NH+](C)CCOC1=CC=C(C=C1)Br

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)[NH+](C)CCOC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H18BrN3O3/c1-9(12(18)16-13(15)19)17(2)7-8-20-11-5-3-10(14)4-6-11/h3-6,9H,7-8H2,1-2H3,(H3,15,16,18,19)/p+1/t9-/m1/s1