1-(1-adamantyl)-4-hex-2-ynyl-piperazin-1-ium

Systemtic Name: 1-(1-adamantyl)-4-hex-2-ynyl-piperazin-1-ium Openeye Name: 1-(1-adamantyl)-4-hex-2-ynyl-piperazin-1-ium CAS Name: 1-(1-adamantyl)-4-hex-2-ynylpiperazin-1-ium IUPAC Name: 1-(1-adamantyl)-4-hex-2-ynylpiperazin-1-ium Traditional Name: 1-(1-adamantyl)-4-hex-2-ynyl-piperazin-1-ium Formula: C20H33N2+ MolecularWeight: 301.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCN1CC[NH+](CC1)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCC#CCN1CC[NH+](CC1)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H32N2/c1-2-3-4-5-6-21-7-9-22(10-8-21)20-14-17-11-18(15-20)13-19(12-17)16-20/h17-19H,2-3,6-16H2,1H3/p+1