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

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(3-phenoxyphenyl)methyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(3-phenoxyphenyl)methyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[(3-phenoxyphenyl)methyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[(3-phenoxyphenyl)methyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-phenoxybenzyl)acetamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCC2=CC(=CC=C2)OC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCC2=CC(=CC=C2)OC3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-14-20(24(26)27)15(2)23(22-14)13-19(25)21-12-16-7-6-10-18(11-16)28-17-8-4-3-5-9-17/h3-11H,12-13H2,1-2H3,(H,21,25)