N-[[2-(azetidin-2-yl)-5-chloranyl-phenyl]methyl]-1-(3,3-dimethyl-2-oxidanyl-butanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[[2-(azetidin-2-yl)-5-chloranyl-phenyl]methyl]-1-(3,3-dimethyl-2-oxidanyl-butanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[[2-(azetidin-2-yl)-5-chloro-phenyl]methyl]-1-(2-hydroxy-3,3-dimethyl-butanoyl)pyrrolidine-2-carboxamide CAS Name: N-[[2-(2-azetidinyl)-5-chlorophenyl]methyl]-1-(2-hydroxy-3,3-dimethyl-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[[2-(azetidin-2-yl)-5-chlorophenyl]methyl]-1-(2-hydroxy-3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[2-(azetidin-2-yl)-5-chloro-benzyl]-1-(2-hydroxy-3,3-dimethyl-butanoyl)pyrrolidine-2-carboxamide Formula: C21H30ClN3O3 MolecularWeight: 407.9342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCCC1C(=O)NCC2=C(C=CC(=C2)Cl)C3CCN3)O

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCCC1C(=O)NCC2=C(C=CC(=C2)Cl)C3CCN3)O

InChI

InChI=1S/C21H30ClN3O3/c1-21(2,3)18(26)20(28)25-10-4-5-17(25)19(27)24-12-13-11-14(22)6-7-15(13)16-8-9-23-16/h6-7,11,16-18,23,26H,4-5,8-10,12H2,1-3H3,(H,24,27)