2-[(2R,4S)-2-(4-fluorophenyl)-4-methyl-4-oxidanyl-2-adamantyl]-1-(3-oxidanylazetidin-1-yl)ethanone

Systemtic Name: 2-[(2R,4S)-2-(4-fluorophenyl)-4-methyl-4-oxidanyl-2-adamantyl]-1-(3-oxidanylazetidin-1-yl)ethanone Openeye Name: 2-[(2R,4S)-2-(4-fluorophenyl)-4-hydroxy-4-methyl-2-adamantyl]-1-(3-hydroxyazetidin-1-yl)ethanone CAS Name: 2-[(2R,4S)-2-(4-fluorophenyl)-4-hydroxy-4-methyl-2-adamantyl]-1-(3-hydroxy-1-azetidinyl)ethanone IUPAC Name: 2-[(2R,4S)-2-(4-fluorophenyl)-4-hydroxy-4-methyl-2-adamantyl]-1-(3-hydroxyazetidin-1-yl)ethanone Traditional Name: 2-[(2R,4S)-2-(4-fluorophenyl)-4-hydroxy-4-methyl-2-adamantyl]-1-(3-hydroxyazetidin-1-yl)ethanone Formula: C22H28FNO3 MolecularWeight: 373.461023

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC3CC(C2)C(C1C3)(CC(=O)N4CC(C4)O)C5=CC=C(C=C5)F)O

Isomeric SMILES

C[C@@]1(C2CC3CC(C2)[C@@](C1C3)(CC(=O)N4CC(C4)O)C5=CC=C(C=C5)F)O

InChI

InChI=1S/C22H28FNO3/c1-21(27)15-6-13-7-16(9-15)22(19(21)8-13,14-2-4-17(23)5-3-14)10-20(26)24-11-18(25)12-24/h2-5,13,15-16,18-19,25,27H,6-12H2,1H3/t13?,15?,16?,19?,21-,22+/m0/s1