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

Systemtic Name: 1-[(2,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(2,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(2,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2,5-dimethylphenoxy)methyl]-N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(2,5-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)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC4=C(C=CC(=C4)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC4=C(C=CC(=C4)C)C)[N+](=O)[O-]

InChI

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