1-(5,5-diphenylpent-4-en-2-ynyl)-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-(5,5-diphenylpent-4-en-2-ynyl)-4-methyl-piperazine-1,4-diium Openeye Name: 1-(5,5-diphenylpent-4-en-2-ynyl)-4-methyl-piperazine-1,4-diium CAS Name: 1-(5,5-diphenylpent-4-en-2-ynyl)-4-methylpiperazine-1,4-diium IUPAC Name: 1-(5,5-diphenylpent-4-en-2-ynyl)-4-methylpiperazine-1,4-diium Traditional Name: 1-(5,5-diphenylpent-4-en-2-ynyl)-4-methyl-piperazine-1,4-diium Formula: C22H26N2+2 MolecularWeight: 318.45524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC#CC=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC#CC=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2/c1-23-16-18-24(19-17-23)15-9-8-14-22(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-7,10-14H,15-19H2,1H3/p+2