1-[4-[(4-bromanyl-2-fluoranyl-phenyl)methylidene]piperidin-1-yl]-2,2-dicyclohexyl-ethanone

Systemtic Name: 1-[4-[(4-bromanyl-2-fluoranyl-phenyl)methylidene]piperidin-1-yl]-2,2-dicyclohexyl-ethanone Openeye Name: 1-[4-[(4-bromo-2-fluoro-phenyl)methylene]-1-piperidyl]-2,2-dicyclohexyl-ethanone CAS Name: 1-[4-[(4-bromo-2-fluorophenyl)methylidene]-1-piperidinyl]-2,2-dicyclohexylethanone IUPAC Name: 1-[4-[(4-bromo-2-fluorophenyl)methylidene]piperidin-1-yl]-2,2-dicyclohexylethanone Traditional Name: 1-[4-(4-bromo-2-fluoro-benzylidene)piperidino]-2,2-dicyclohexyl-ethanone Formula: C26H35BrFNO MolecularWeight: 476.464603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2CCCCC2)C(=O)N3CCC(=CC4=C(C=C(C=C4)Br)F)CC3

Isomeric SMILES

C1CCC(CC1)C(C2CCCCC2)C(=O)N3CCC(=CC4=C(C=C(C=C4)Br)F)CC3

InChI

InChI=1S/C26H35BrFNO/c27-23-12-11-22(24(28)18-23)17-19-13-15-29(16-14-19)26(30)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h11-12,17-18,20-21,25H,1-10,13-16H2