2-[(4-azanyl-1,2,5-oxadiazol-3-yl)carbonylamino]ethyl-[(4-bromophenyl)methyl]azanium

Systemtic Name: 2-[(4-azanyl-1,2,5-oxadiazol-3-yl)carbonylamino]ethyl-[(4-bromophenyl)methyl]azanium Openeye Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(4-bromophenyl)methyl]ammonium CAS Name: 2-[[(4-amino-1,2,5-oxadiazol-3-yl)-oxomethyl]amino]ethyl-[(4-bromophenyl)methyl]ammonium IUPAC Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(4-bromophenyl)methyl]azanium Traditional Name: 2-[(4-aminofurazan-3-carbonyl)amino]ethyl-(4-bromobenzyl)ammonium Formula: C12H15BrN5O2+ MolecularWeight: 341.1838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CCNC(=O)C2=NON=C2N)Br

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]CCNC(=O)C2=NON=C2N)Br

InChI

InChI=1S/C12H14BrN5O2/c13-9-3-1-8(2-4-9)7-15-5-6-16-12(19)10-11(14)18-20-17-10/h1-4,15H,5-7H2,(H2,14,18)(H,16,19)/p+1