1-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[5-(2-bromo-4-nitrophenyl)-2-furanyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[5-(2-bromo-4-nitrophenyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (Z)-[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene-(1,2,4-triazol-4-yl)amine Formula: C13H8BrN5O3 MolecularWeight: 362.13832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)C=NN3C=NN=C3

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)/C=N\N3C=NN=C3

InChI

InChI=1S/C13H8BrN5O3/c14-12-5-9(19(20)21)1-3-11(12)13-4-2-10(22-13)6-17-18-7-15-16-8-18/h1-8H/b17-6-