1-[4-[4-(1-adamantylcarbonyl)piperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(1-adamantylcarbonyl)piperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-(adamantane-1-carbonyl)piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(adamantane-1-carbonyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(adamantane-1-carbonyl)piperazino]-3-fluoro-phenyl]ethanone Formula: C23H29FN2O2 MolecularWeight: 384.486963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)F

InChI

InChI=1S/C23H29FN2O2/c1-15(27)19-2-3-21(20(24)11-19)25-4-6-26(7-5-25)22(28)23-12-16-8-17(13-23)10-18(9-16)14-23/h2-3,11,16-18H,4-10,12-14H2,1H3