N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C17H11Cl2IN4O4 MolecularWeight: 533.10411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11Cl2IN4O4/c1-23-8-14(20)16(22-23)17(25)21-10-5-11(24(26)27)7-12(6-10)28-15-3-2-9(18)4-13(15)19/h2-8H,1H3,(H,21,25)