N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-ethynyl-benzamide

Systemtic Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-ethynyl-benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-ethynyl-benzamide CAS Name: N-[1-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-ethynylbenzamide IUPAC Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-ethynylbenzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-ethynyl-benzamide Formula: C18H19N3O2 MolecularWeight: 309.36236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)C(=O)NC2(CCCCC2)C(=O)NCC#N

Isomeric SMILES

C#CC1=CC=C(C=C1)C(=O)NC2(CCCCC2)C(=O)NCC#N

InChI

InChI=1S/C18H19N3O2/c1-2-14-6-8-15(9-7-14)16(22)21-18(10-4-3-5-11-18)17(23)20-13-12-19/h1,6-9H,3-5,10-11,13H2,(H,20,23)(H,21,22)