[2-[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]oxy-5-bromanyl-phenyl]methylazanium

Systemtic Name: [2-[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]oxy-5-bromanyl-phenyl]methylazanium Openeye Name: [5-bromo-2-[(1S)-1-methyl-2-oxo-2-ureido-ethoxy]phenyl]methylammonium CAS Name: [5-bromo-2-[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [5-bromo-2-[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [5-bromo-2-[(1S)-2-keto-1-methyl-2-ureido-ethoxy]benzyl]ammonium Formula: C11H15BrN3O3+ MolecularWeight: 317.1591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC1=C(C=C(C=C1)Br)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)OC1=C(C=C(C=C1)Br)C[NH3+]

InChI

InChI=1S/C11H14BrN3O3/c1-6(10(16)15-11(14)17)18-9-3-2-8(12)4-7(9)5-13/h2-4,6H,5,13H2,1H3,(H3,14,15,16,17)/p+1/t6-/m0/s1