5-[2-(4-nitroimidazol-1-yl)ethyl]-N-phenyl-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[2-(4-nitroimidazol-1-yl)ethyl]-N-phenyl-1H-1,2,4-triazol-3-amine Openeye Name: 5-[2-(4-nitroimidazol-1-yl)ethyl]-N-phenyl-1H-1,2,4-triazol-3-amine CAS Name: 5-[2-(4-nitro-1-imidazolyl)ethyl]-N-phenyl-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[2-(4-nitroimidazol-1-yl)ethyl]-N-phenyl-1H-1,2,4-triazol-3-amine Traditional Name: [5-[2-(4-nitroimidazol-1-yl)ethyl]-1H-1,2,4-triazol-3-yl]-phenyl-amine Formula: C13H13N7O2 MolecularWeight: 299.28802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NNC(=N2)CCN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NNC(=N2)CCN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N7O2/c21-20(22)12-8-19(9-14-12)7-6-11-16-13(18-17-11)15-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H2,15,16,17,18)