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

Systemtic Name: 2-[(4-azanyl-1,2,5-oxadiazol-3-yl)carbonylamino]ethyl-[(3-chlorophenyl)methyl]azanium Openeye Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(3-chlorophenyl)methyl]ammonium CAS Name: 2-[[(4-amino-1,2,5-oxadiazol-3-yl)-oxomethyl]amino]ethyl-[(3-chlorophenyl)methyl]ammonium IUPAC Name: 2-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]ethyl-[(3-chlorophenyl)methyl]azanium Traditional Name: 2-[(4-aminofurazan-3-carbonyl)amino]ethyl-(3-chlorobenzyl)ammonium Formula: C12H15ClN5O2+ MolecularWeight: 296.7328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C[NH2+]CCNC(=O)C2=NON=C2N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C[NH2+]CCNC(=O)C2=NON=C2N

InChI

InChI=1S/C12H14ClN5O2/c13-9-3-1-2-8(6-9)7-15-4-5-16-12(19)10-11(14)18-20-17-10/h1-3,6,15H,4-5,7H2,(H2,14,18)(H,16,19)/p+1