1-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine

Systemtic Name: 1-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine Openeye Name: 1-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine CAS Name: 1-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine IUPAC Name: 1-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine Traditional Name: (E)-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]benzylidene]-(1H-1,2,4-triazol-5-yl)amine Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)C=NC3=NC=NN3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)/C=N/C3=NC=NN3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4/c1-12-7-15(4-5-16(12)23(24)25)27-10-14-8-13(3-6-17(14)26-2)9-19-18-20-11-21-22-18/h3-9,11H,10H2,1-2H3,(H,20,21,22)/b19-9+