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

Systemtic Name: 1-[5-(4,5-dimethyl-2-nitro-phenyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[5-(4,5-dimethyl-2-nitro-phenyl)-2-furyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[5-(4,5-dimethyl-2-nitrophenyl)-2-furanyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-[5-(4,5-dimethyl-2-nitro-phenyl)-2-furyl]methylene-(1,2,4-triazol-4-yl)amine Formula: C15H13N5O3 MolecularWeight: 311.29542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=CC=C(O2)C=NN3C=NN=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=CC=C(O2)/C=N/N3C=NN=C3)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N5O3/c1-10-5-13(14(20(21)22)6-11(10)2)15-4-3-12(23-15)7-18-19-8-16-17-9-19/h3-9H,1-2H3/b18-7+