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

Systemtic Name: N3-[(E)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine Openeye Name: N3-[(E)-(2-chloro-5-nitro-phenyl)methyleneamino]-5-methyl-1,2,4-triazole-3,4-diamine CAS Name: N3-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine IUPAC Name: 3-N-[(E)-(2-chloro-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-chloro-5-nitro-benzylidene)amino]amine Formula: C10H10ClN7O2 MolecularWeight: 295.6851

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN7O2/c1-6-14-16-10(17(6)12)15-13-5-7-4-8(18(19)20)2-3-9(7)11/h2-5H,12H2,1H3,(H,15,16)/b13-5+