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

Systemtic Name: N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C17H11Cl2N5O6 MolecularWeight: 452.20514

Click to see the large picture

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-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H11Cl2N5O6/c1-22-8-14(24(28)29)16(21-22)17(25)20-10-5-11(23(26)27)7-12(6-10)30-15-3-2-9(18)4-13(15)19/h2-8H,1H3,(H,20,25)