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

Systemtic Name: N3-[(E)-(3,4-diethoxy-5-nitro-phenyl)methylideneamino]-1,2,4-triazole-3,4-diamine Openeye Name: N3-[(E)-(3,4-diethoxy-5-nitro-phenyl)methyleneamino]-1,2,4-triazole-3,4-diamine CAS Name: N3-[(E)-(3,4-diethoxy-5-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine IUPAC Name: 3-N-[(E)-(3,4-diethoxy-5-nitrophenyl)methylideneamino]-1,2,4-triazole-3,4-diamine Traditional Name: (4-amino-1,2,4-triazol-3-yl)-[(E)-(3,4-diethoxy-5-nitro-benzylidene)amino]amine Formula: C13H17N7O4 MolecularWeight: 335.31858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)[N+](=O)[O-])C=NNC2=NN=CN2N

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)[N+](=O)[O-])/C=N/NC2=NN=CN2N

InChI

InChI=1S/C13H17N7O4/c1-3-23-11-6-9(5-10(20(21)22)12(11)24-4-2)7-15-17-13-18-16-8-19(13)14/h5-8H,3-4,14H2,1-2H3,(H,17,18)/b15-7+