1-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-(2-chloranyl-4-fluoranyl-phenoxy)ethanone

Systemtic Name: 1-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-(2-chloranyl-4-fluoranyl-phenoxy)ethanone Openeye Name: 1-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-(2-chloro-4-fluoro-phenoxy)ethanone CAS Name: 1-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-2-(2-chloro-4-fluorophenoxy)ethanone IUPAC Name: 1-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-(2-chloro-4-fluorophenoxy)ethanone Traditional Name: 1-[4-(adamantane-1-carbonyl)piperazino]-2-(2-chloro-4-fluoro-phenoxy)ethanone Formula: C23H28ClFN2O3 MolecularWeight: 434.931423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Cl)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Cl)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28ClFN2O3/c24-19-10-18(25)1-2-20(19)30-14-21(28)26-3-5-27(6-4-26)22(29)23-11-15-7-16(12-23)9-17(8-15)13-23/h1-2,10,15-17H,3-9,11-14H2