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

Systemtic Name: 1-[4-(5-methyl-2-propan-2-yl-phenoxy)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[4-(2-isopropyl-5-methyl-phenoxy)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[4-(5-methyl-2-propan-2-ylphenoxy)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[4-(5-methyl-2-propan-2-ylphenoxy)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (Z)-[4-(2-isopropyl-5-methyl-phenoxy)-3-nitro-benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC2=C(C=C(C=C2)C=NN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC2=C(C=C(C=C2)/C=N\N3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c1-13(2)16-6-4-14(3)8-19(16)27-18-7-5-15(9-17(18)24(25)26)10-22-23-11-20-21-12-23/h4-13H,1-3H3/b22-10-