(2S)-N-[(3-chlorophenyl)methyl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(3-chlorophenyl)methyl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(3-chlorophenyl)methyl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(3-chlorophenyl)methyl]-1-(3,3-dimethyl-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(3-chlorophenyl)methyl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(3-chlorobenzyl)-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Formula: C18H25ClN2O2 MolecularWeight: 336.8563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H25ClN2O2/c1-18(2,3)11-16(22)21-9-5-8-15(21)17(23)20-12-13-6-4-7-14(19)10-13/h4,6-7,10,15H,5,8-9,11-12H2,1-3H3,(H,20,23)/t15-/m0/s1