N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C22H18ClN7O6 MolecularWeight: 511.87462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC4=CC=C(C=C4)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C22H18ClN7O6/c1-13-21(30(34)35)14(2)28(25-13)12-27-8-7-20(26-27)22(31)24-16-9-17(29(32)33)11-19(10-16)36-18-5-3-15(23)4-6-18/h3-11H,12H2,1-2H3,(H,24,31)