N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-(4-ethanoylphenyl)piperazine-1-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-(4-ethanoylphenyl)piperazine-1-carboxamide Openeye Name: 4-(4-acetylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(4-acetylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-acetylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(4-acetylphenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C20H19ClF3N3O2 MolecularWeight: 425.83197

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H19ClF3N3O2/c1-13(28)14-2-5-16(6-3-14)26-8-10-27(11-9-26)19(29)25-18-12-15(20(22,23)24)4-7-17(18)21/h2-7,12H,8-11H2,1H3,(H,25,29)