1-[(2-nitrophenyl)methyl]-1,5-dihydro-1,2,4-triazol-1-ium-4-amine

Systemtic Name: 1-[(2-nitrophenyl)methyl]-1,5-dihydro-1,2,4-triazol-1-ium-4-amine Openeye Name: 1-[(2-nitrophenyl)methyl]-1,5-dihydro-1,2,4-triazol-1-ium-4-amine CAS Name: 1-[(2-nitrophenyl)methyl]-1,5-dihydro-1,2,4-triazol-1-ium-4-amine IUPAC Name: 1-[(2-nitrophenyl)methyl]-1,5-dihydro-1,2,4-triazol-1-ium-4-amine Traditional Name: [1-(2-nitrobenzyl)-1,5-dihydro-1,2,4-triazol-1-ium-4-yl]amine Formula: C9H12N5O2+ MolecularWeight: 222.22388

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Descriptors Computed from Structure

Canonical SMILES:

C1[NH+](N=CN1N)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1[NH+](N=CN1N)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C9H11N5O2/c10-12-6-11-13(7-12)5-8-3-1-2-4-9(8)14(15)16/h1-4,6H,5,7,10H2/p+1