N-(4-methyl-2-nitro-phenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]acetamide Traditional Name: N-(4-methyl-2-nitro-phenyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]acetamide Formula: C19H20F3N5O3 MolecularWeight: 423.38901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20F3N5O3/c1-13-2-4-15(16(10-13)27(29)30)24-18(28)12-25-6-8-26(9-7-25)17-5-3-14(11-23-17)19(20,21)22/h2-5,10-11H,6-9,12H2,1H3,(H,24,28)