N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C22H24F3N5O4 MolecularWeight: 479.45227

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H24F3N5O4/c1-14(16-4-3-5-18(12-16)27-15(2)31)26-21(32)29-10-8-28(9-11-29)19-7-6-17(22(23,24)25)13-20(19)30(33)34/h3-7,12-14H,8-11H2,1-2H3,(H,26,32)(H,27,31)