(E)-N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[(3-bromo-4-fluoro-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-N-[(3-bromo-4-fluorophenyl)methyl]-N,6,6-trimethyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-[(3-bromo-4-fluorophenyl)methyl]-N,6,6-trimethylhept-2-en-4-yn-1-amine Traditional Name: (3-bromo-4-fluoro-benzyl)-[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amine Formula: C17H21BrFN MolecularWeight: 338.257743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CC1=CC(=C(C=C1)F)Br

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CC1=CC(=C(C=C1)F)Br

InChI

InChI=1S/C17H21BrFN/c1-17(2,3)10-6-5-7-11-20(4)13-14-8-9-16(19)15(18)12-14/h5,7-9,12H,11,13H2,1-4H3/b7-5+