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

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(2-cyano-4-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(2-cyano-4-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(2-cyano-4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(2-cyano-4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(2-cyano-4-nitro-phenyl)pyrazole-3-carboxamide Formula: C18H11ClN6O6 MolecularWeight: 442.76954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H11ClN6O6/c19-14-8-13(25(29)30)2-4-17(14)31-10-23-6-5-16(22-23)18(26)21-15-3-1-12(24(27)28)7-11(15)9-20/h1-8H,10H2,(H,21,26)