N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide CAS Name: N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]-2-(3-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-(3-methyl-4-nitrophenoxy)acetamide Traditional Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C21H22N4O4/c1-13-5-7-17(8-6-13)24-16(4)21(15(3)23-24)22-20(26)12-29-18-9-10-19(25(27)28)14(2)11-18/h5-11H,12H2,1-4H3,(H,22,26)