1-[1-(4-chloranyl-3-nitro-phenyl)pyrrol-2-yl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[1-(4-chloranyl-3-nitro-phenyl)pyrrol-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[1-(4-chloro-3-nitro-phenyl)pyrrol-2-yl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[1-(4-chloro-3-nitrophenyl)-2-pyrrolyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[1-(4-chloro-3-nitrophenyl)pyrrol-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: [1-(4-chloro-3-nitro-phenyl)pyrrol-2-yl]methylene-(1,2,4-triazol-4-yl)amine Formula: C13H9ClN6O2 MolecularWeight: 316.70256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=NN2C=NN=C2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C(=C1)C=NN2C=NN=C2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClN6O2/c14-12-4-3-10(6-13(12)20(21)22)19-5-1-2-11(19)7-17-18-8-15-16-9-18/h1-9H