2-(3-bromanyl-1-adamantyl)-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(3-bromo-1-adamantyl)-1-[4-(4-fluorobenzoyl)piperazin-1-yl]ethanone CAS Name: 2-(3-bromo-1-adamantyl)-1-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromo-1-adamantyl)-1-[4-(4-fluorobenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-(3-bromo-1-adamantyl)-1-[4-(4-fluorobenzoyl)piperazino]ethanone Formula: C23H28BrFN2O2 MolecularWeight: 463.383023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC23CC4CC(C2)CC(C4)(C3)Br)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C(=O)CC23CC4CC(C2)CC(C4)(C3)Br)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H28BrFN2O2/c24-23-12-16-9-17(13-23)11-22(10-16,15-23)14-20(28)26-5-7-27(8-6-26)21(29)18-1-3-19(25)4-2-18/h1-4,16-17H,5-15H2