N-[(2-fluorophenyl)methyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: N-[(2-fluorophenyl)methyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: N-[(2-fluorophenyl)methyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-[(2-fluorophenyl)methyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: N-(2-fluorobenzyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C19H18F4N4O3 MolecularWeight: 426.364833

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3F

InChI

InChI=1S/C19H18F4N4O3/c20-15-4-2-1-3-13(15)12-24-18(28)26-9-7-25(8-10-26)16-6-5-14(19(21,22)23)11-17(16)27(29)30/h1-6,11H,7-10,12H2,(H,24,28)