N-(2-cyclohexylcyclohexyl)-3-ethynyl-aniline

Systemtic Name: N-(2-cyclohexylcyclohexyl)-3-ethynyl-aniline Openeye Name: N-(2-cyclohexylcyclohexyl)-3-ethynyl-aniline CAS Name: N-(2-cyclohexylcyclohexyl)-3-ethynylaniline IUPAC Name: N-(2-cyclohexylcyclohexyl)-3-ethynylaniline Traditional Name: (2-cyclohexylcyclohexyl)-(3-ethynylphenyl)amine Formula: C20H27N MolecularWeight: 281.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2CCCCC2C3CCCCC3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2CCCCC2C3CCCCC3

InChI

InChI=1S/C20H27N/c1-2-16-9-8-12-18(15-16)21-20-14-7-6-13-19(20)17-10-4-3-5-11-17/h1,8-9,12,15,17,19-21H,3-7,10-11,13-14H2