1-(2-adamantyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium

Systemtic Name: 1-(2-adamantyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Openeye Name: 1-(2-adamantyl)-4-[(E)-cinnamyl]piperazin-1-ium CAS Name: 1-(2-adamantyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium IUPAC Name: 1-(2-adamantyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Traditional Name: 1-(2-adamantyl)-4-[(E)-cinnamyl]piperazin-1-ium Formula: C23H33N2+ MolecularWeight: 337.52152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)CC=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C23H32N2/c1-2-5-18(6-3-1)7-4-8-24-9-11-25(12-10-24)23-21-14-19-13-20(16-21)17-22(23)15-19/h1-7,19-23H,8-17H2/p+1/b7-4+