N-(4-methylphenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-N-(p-tolyl)acetamide Formula: C20H21F3N4O3 MolecularWeight: 422.40095

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21F3N4O3/c1-14-2-5-16(6-3-14)24-19(28)13-25-8-10-26(11-9-25)17-7-4-15(20(21,22)23)12-18(17)27(29)30/h2-7,12H,8-11,13H2,1H3,(H,24,28)