2-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[1-[(2-chloro-4-fluoro-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-2-piperazinyl]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxopiperazin-2-yl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[1-(2-chloro-4-fluoro-benzyl)-3-keto-piperazin-2-yl]-N-(3-phenylpropyl)acetamide Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NCCCC2=CC=CC=C2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NCCCC2=CC=CC=C2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H25ClFN3O2/c23-19-13-18(24)9-8-17(19)15-27-12-11-26-22(29)20(27)14-21(28)25-10-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-9,13,20H,4,7,10-12,14-15H2,(H,25,28)(H,26,29)