1-[3-[(4-iodanylphenoxy)methyl]-4-methoxy-phenyl]-N-(4-nitropyrazol-1-yl)methanimine

Systemtic Name: 1-[3-[(4-iodanylphenoxy)methyl]-4-methoxy-phenyl]-N-(4-nitropyrazol-1-yl)methanimine Openeye Name: 1-[3-[(4-iodophenoxy)methyl]-4-methoxy-phenyl]-N-(4-nitropyrazol-1-yl)methanimine CAS Name: 1-[3-[(4-iodophenoxy)methyl]-4-methoxyphenyl]-N-(4-nitro-1-pyrazolyl)methanimine IUPAC Name: 1-[3-[(4-iodophenoxy)methyl]-4-methoxyphenyl]-N-(4-nitropyrazol-1-yl)methanimine Traditional Name: (E)-[3-[(4-iodophenoxy)methyl]-4-methoxy-benzylidene]-(4-nitropyrazol-1-yl)amine Formula: C18H15IN4O4 MolecularWeight: 478.24057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2C=C(C=N2)[N+](=O)[O-])COC3=CC=C(C=C3)I

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/N2C=C(C=N2)[N+](=O)[O-])COC3=CC=C(C=C3)I

InChI

InChI=1S/C18H15IN4O4/c1-26-18-7-2-13(9-20-22-11-16(10-21-22)23(24)25)8-14(18)12-27-17-5-3-15(19)4-6-17/h2-11H,12H2,1H3/b20-9+