1-(2-adamantyl)-4-[2-chloranyl-3-(trifluoromethyl)phenyl]-3,3-dimethyl-azetidin-2-one

Systemtic Name: 1-(2-adamantyl)-4-[2-chloranyl-3-(trifluoromethyl)phenyl]-3,3-dimethyl-azetidin-2-one Openeye Name: 1-(2-adamantyl)-4-[2-chloro-3-(trifluoromethyl)phenyl]-3,3-dimethyl-azetidin-2-one CAS Name: 1-(2-adamantyl)-4-[2-chloro-3-(trifluoromethyl)phenyl]-3,3-dimethyl-2-azetidinone IUPAC Name: 1-(2-adamantyl)-4-[2-chloro-3-(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one Traditional Name: 1-(2-adamantyl)-4-[2-chloro-3-(trifluoromethyl)phenyl]-3,3-dimethyl-azetidin-2-one Formula: C22H25ClF3NO MolecularWeight: 411.88821

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C1=O)C2C3CC4CC(C3)CC2C4)C5=C(C(=CC=C5)C(F)(F)F)Cl)C

Isomeric SMILES

CC1(C(N(C1=O)C2C3CC4CC(C3)CC2C4)C5=C(C(=CC=C5)C(F)(F)F)Cl)C

InChI

InChI=1S/C22H25ClF3NO/c1-21(2)19(15-4-3-5-16(17(15)23)22(24,25)26)27(20(21)28)18-13-7-11-6-12(9-13)10-14(18)8-11/h3-5,11-14,18-19H,6-10H2,1-2H3