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

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-2-[5-methyl-4-nitro-3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-(3,4-diethoxybenzyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C18H21F3N4O5 MolecularWeight: 430.37835

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CN2C(=C(C(=N2)C(F)(F)F)[N+](=O)[O-])C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CN2C(=C(C(=N2)C(F)(F)F)[N+](=O)[O-])C)OCC

InChI

InChI=1S/C18H21F3N4O5/c1-4-29-13-7-6-12(8-14(13)30-5-2)9-22-15(26)10-24-11(3)16(25(27)28)17(23-24)18(19,20)21/h6-8H,4-5,9-10H2,1-3H3,(H,22,26)