N3-[(E)-(2-methoxy-5-nitro-phenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine

Systemtic Name: N3-[(E)-(2-methoxy-5-nitro-phenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine Openeye Name: N3-[(E)-(2-methoxy-5-nitro-phenyl)methyleneamino]-5-methyl-1,2,4-triazole-3,4-diamine CAS Name: N3-[(E)-(2-methoxy-5-nitrophenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine IUPAC Name: 3-N-[(E)-(2-methoxy-5-nitrophenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine Traditional Name: (4-amino-5-methyl-1,2,4-triazol-3-yl)-[(E)-(2-methoxy-5-nitro-benzylidene)amino]amine Formula: C11H13N7O3 MolecularWeight: 291.26602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=NN=C(N1N)N/N=C/C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C11H13N7O3/c1-7-14-16-11(17(7)12)15-13-6-8-5-9(18(19)20)3-4-10(8)21-2/h3-6H,12H2,1-2H3,(H,15,16)/b13-6+