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

Systemtic Name: N-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide CAS Name: N-[1-[(4-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-(3-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-[1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-(3-methyl-4-nitrophenoxy)acetamide Traditional Name: N-[1-(4-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C21H21FN4O4 MolecularWeight: 412.414243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21FN4O4/c1-13-10-18(8-9-19(13)26(28)29)30-12-20(27)23-21-14(2)24-25(15(21)3)11-16-4-6-17(22)7-5-16/h4-10H,11-12H2,1-3H3,(H,23,27)