5-ethyl-N3-[(E)-(4-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine

Systemtic Name: 5-ethyl-N3-[(E)-(4-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine Openeye Name: 5-ethyl-N3-[(E)-(4-nitrophenyl)methyleneamino]-1,2,4-triazole-3,4-diamine CAS Name: 5-ethyl-N3-[(E)-(4-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine IUPAC Name: 5-ethyl-3-N-[(E)-(4-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine Traditional Name: (4-amino-5-ethyl-1,2,4-triazol-3-yl)-[(E)-(4-nitrobenzylidene)amino]amine Formula: C11H13N7O2 MolecularWeight: 275.26662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(N1N)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N7O2/c1-2-10-14-16-11(17(10)12)15-13-7-8-3-5-9(6-4-8)18(19)20/h3-7H,2,12H2,1H3,(H,15,16)/b13-7+