N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methyl-pyrrolidine-2-carboxamide Openeye Name: N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methyl-pyrrolidine-2-carboxamide CAS Name: N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methyl-2-pyrrolidinecarboxamide IUPAC Name: N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methylpyrrolidine-2-carboxamide Traditional Name: N-(cyanomethyl)-1-[3-(3,3-dimethylbut-1-ynyl)phenyl]-4-methyl-pyrrolidine-2-carboxamide Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1)C2=CC=CC(=C2)C#CC(C)(C)C)C(=O)NCC#N

Isomeric SMILES

CC1CC(N(C1)C2=CC=CC(=C2)C#CC(C)(C)C)C(=O)NCC#N

InChI

InChI=1S/C20H25N3O/c1-15-12-18(19(24)22-11-10-21)23(14-15)17-7-5-6-16(13-17)8-9-20(2,3)4/h5-7,13,15,18H,11-12,14H2,1-4H3,(H,22,24)