1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(3-nitro-4-pyrrolidin-1-ylphenyl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (Z)-(3-nitro-4-pyrrolidino-benzylidene)-(1,2,4-triazol-4-yl)amine Formula: C13H14N6O2 MolecularWeight: 286.28926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C=NN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)/C=N\N3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O2/c20-19(21)13-7-11(8-16-18-9-14-15-10-18)3-4-12(13)17-5-1-2-6-17/h3-4,7-10H,1-2,5-6H2/b16-8-