5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[3-(4-nitrophenyl)propyl]-1H-1,2,4-triazol-3-yl]amine Formula: C11H13N5O2 MolecularWeight: 247.25322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC2=NC(=NN2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCCC2=NC(=NN2)N)[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O2/c12-11-13-10(14-15-11)3-1-2-8-4-6-9(7-5-8)16(17)18/h4-7H,1-3H2,(H3,12,13,14,15)