4-iodanyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-iodanyl-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-iodo-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-1-methyl-pyrazole-3-carboxamide CAS Name: 4-iodo-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-iodo-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-1-methylpyrazole-3-carboxamide Traditional Name: 4-iodo-N-[3-(4-methoxyphenoxy)-5-nitro-phenyl]-1-methyl-pyrazole-3-carboxamide Formula: C18H15IN4O5 MolecularWeight: 494.23997

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-])I

InChI

InChI=1S/C18H15IN4O5/c1-22-10-16(19)17(21-22)18(24)20-11-7-12(23(25)26)9-15(8-11)28-14-5-3-13(27-2)4-6-14/h3-10H,1-2H3,(H,20,24)