2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]acetamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H23N5O4/c1-13-5-6-14(2)18(9-13)30-20-8-7-17(11-23-20)10-22-19(27)12-25-16(4)21(26(28)29)15(3)24-25/h5-9,11H,10,12H2,1-4H3,(H,22,27)