1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC(=CC(=C4)C)C

InChI

InChI=1S/C27H26N4O5/c1-17-5-6-20(4)26(12-17)36-24-14-21(13-22(15-24)31(33)34)28-27(32)25-7-8-30(29-25)16-35-23-10-18(2)9-19(3)11-23/h5-15H,16H2,1-4H3,(H,28,32)