1-(2,5-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide

Systemtic Name: 1-(2,5-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide Openeye Name: 1-(2,5-dimethylphenyl)-N-isobutyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide CAS Name: 1-(2,5-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)-3-pyrazolecarboxamide IUPAC Name: 1-(2,5-dimethylphenyl)-4-methyl-N-(2-methylpropyl)-5-(2-nitrophenoxy)pyrazole-3-carboxamide Traditional Name: 1-(2,5-dimethylphenyl)-N-isobutyl-4-methyl-5-(2-nitrophenoxy)pyrazole-3-carboxamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C(=O)NCC(C)C)C)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C(=O)NCC(C)C)C)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-14(2)13-24-22(28)21-17(5)23(31-20-9-7-6-8-18(20)27(29)30)26(25-21)19-12-15(3)10-11-16(19)4/h6-12,14H,13H2,1-5H3,(H,24,28)