2-(2-adamantyl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4,4-dimethyl-1,2-diazetidin-3-one

Systemtic Name: 2-(2-adamantyl)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4,4-dimethyl-1,2-diazetidin-3-one Openeye Name: 2-(2-adamantyl)-1-[(2-chloro-6-fluoro-phenyl)methyl]-4,4-dimethyl-diazetidin-3-one CAS Name: 2-(2-adamantyl)-1-[(2-chloro-6-fluorophenyl)methyl]-4,4-dimethyl-3-diazetidinone IUPAC Name: 2-(2-adamantyl)-1-[(2-chloro-6-fluorophenyl)methyl]-4,4-dimethyldiazetidin-3-one Traditional Name: 2-(2-adamantyl)-1-(2-chloro-6-fluoro-benzyl)-4,4-dimethyl-diazetidin-3-one Formula: C21H26ClFN2O MolecularWeight: 376.895343

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(N1CC2=C(C=CC=C2Cl)F)C3C4CC5CC(C4)CC3C5)C

Isomeric SMILES

CC1(C(=O)N(N1CC2=C(C=CC=C2Cl)F)C3C4CC5CC(C4)CC3C5)C

InChI

InChI=1S/C21H26ClFN2O/c1-21(2)20(26)25(24(21)11-16-17(22)4-3-5-18(16)23)19-14-7-12-6-13(9-14)10-15(19)8-12/h3-5,12-15,19H,6-11H2,1-2H3