N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(3-methylpyrazol-1-yl)ethanamide

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(3-methylpyrazol-1-yl)ethanamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(3-methylpyrazol-1-yl)acetamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-2-(3-methyl-1-pyrazolyl)acetamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-2-(3-methylpyrazol-1-yl)acetamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-(3-methylpyrazol-1-yl)acetamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CC(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1)CC(=O)NC2=CC(=CC(=C2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-13-6-14(2)8-18(7-13)28-19-10-16(9-17(11-19)24(26)27)21-20(25)12-23-5-4-15(3)22-23/h4-11H,12H2,1-3H3,(H,21,25)