N-(cyanomethyl)-2-(2-phenylethynyl)cyclohexane-1-carboxamide

Systemtic Name: N-(cyanomethyl)-2-(2-phenylethynyl)cyclohexane-1-carboxamide Openeye Name: N-(cyanomethyl)-2-(2-phenylethynyl)cyclohexanecarboxamide CAS Name: N-(cyanomethyl)-2-(2-phenylethynyl)-1-cyclohexanecarboxamide IUPAC Name: N-(cyanomethyl)-2-(2-phenylethynyl)cyclohexane-1-carboxamide Traditional Name: N-(cyanomethyl)-2-(2-phenylethynyl)cyclohexanecarboxamide Formula: C17H18N2O MolecularWeight: 266.33762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C#CC2=CC=CC=C2)C(=O)NCC#N

Isomeric SMILES

C1CCC(C(C1)C#CC2=CC=CC=C2)C(=O)NCC#N

InChI

InChI=1S/C17H18N2O/c18-12-13-19-17(20)16-9-5-4-8-15(16)11-10-14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-9,13H2,(H,19,20)