2-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-N-pentan-3-ylacetamide IUPAC Name: 2-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-N-pentan-3-ylacetamide Traditional Name: 2-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-N-(1-ethylpropyl)acetamide Formula: C18H25ClFN3O2 MolecularWeight: 369.861403

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)F

Isomeric SMILES

CCC(CC)NC(=O)CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)Cl)F

InChI

InChI=1S/C18H25ClFN3O2/c1-3-14(4-2)21-17(24)12-22-7-9-23(10-8-22)18(25)15-11-13(19)5-6-16(15)20/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,21,24)