4-tert-butyl-1-but-1-ynyl-N-(phenylmethyl)cyclohexan-1-amine

Systemtic Name: 4-tert-butyl-1-but-1-ynyl-N-(phenylmethyl)cyclohexan-1-amine Openeye Name: N-benzyl-4-tert-butyl-1-but-1-ynyl-cyclohexanamine CAS Name: 4-tert-butyl-1-but-1-ynyl-N-(phenylmethyl)-1-cyclohexanamine IUPAC Name: N-benzyl-4-tert-butyl-1-but-1-ynylcyclohexan-1-amine Traditional Name: benzyl-(4-tert-butyl-1-but-1-ynyl-cyclohexyl)amine Formula: C21H31N MolecularWeight: 297.47754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1(CCC(CC1)C(C)(C)C)NCC2=CC=CC=C2

Isomeric SMILES

CCC#CC1(CCC(CC1)C(C)(C)C)NCC2=CC=CC=C2

InChI

InChI=1S/C21H31N/c1-5-6-14-21(22-17-18-10-8-7-9-11-18)15-12-19(13-16-21)20(2,3)4/h7-11,19,22H,5,12-13,15-17H2,1-4H3