[3-(aminocarbonylamino)-3-oxidanylidene-propyl]-[2-(4-bromanylphenoxy)ethyl]-methyl-azanium

Systemtic Name: [3-(aminocarbonylamino)-3-oxidanylidene-propyl]-[2-(4-bromanylphenoxy)ethyl]-methyl-azanium Openeye Name: 2-(4-bromophenoxy)ethyl-methyl-(3-oxo-3-ureido-propyl)ammonium CAS Name: 2-(4-bromophenoxy)ethyl-[3-(carbamoylamino)-3-oxopropyl]-methylammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-[3-(carbamoylamino)-3-oxopropyl]-methylazanium Traditional Name: 2-(4-bromophenoxy)ethyl-(3-keto-3-ureido-propyl)-methyl-ammonium Formula: C13H19BrN3O3+ MolecularWeight: 345.21226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18BrN3O3/c1-17(7-6-12(18)16-13(15)19)8-9-20-11-4-2-10(14)3-5-11/h2-5H,6-9H2,1H3,(H3,15,16,18,19)/p+1