[2-[2-(aminocarbonylamino)-2-oxidanylidene-ethoxy]-5-bromanyl-phenyl]methylazanium

Systemtic Name: [2-[2-(aminocarbonylamino)-2-oxidanylidene-ethoxy]-5-bromanyl-phenyl]methylazanium Openeye Name: [5-bromo-2-(2-oxo-2-ureido-ethoxy)phenyl]methylammonium CAS Name: [5-bromo-2-[2-(carbamoylamino)-2-oxoethoxy]phenyl]methylammonium IUPAC Name: [5-bromo-2-[2-(carbamoylamino)-2-oxoethoxy]phenyl]methylazanium Traditional Name: [5-bromo-2-(2-keto-2-ureido-ethoxy)benzyl]ammonium Formula: C10H13BrN3O3+ MolecularWeight: 303.13252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C[NH3+])OCC(=O)NC(=O)N

Isomeric SMILES

C1=CC(=C(C=C1Br)C[NH3+])OCC(=O)NC(=O)N

InChI

InChI=1S/C10H12BrN3O3/c11-7-1-2-8(6(3-7)4-12)17-5-9(15)14-10(13)16/h1-3H,4-5,12H2,(H3,13,14,15,16)/p+1