1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium

Systemtic Name: 1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium Openeye Name: 1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium CAS Name: 1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium IUPAC Name: 1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium Traditional Name: 1-(2-adamantyl)-4-(3-phenylpropyl)piperazine-1,4-diium Formula: C23H36N2+2 MolecularWeight: 340.54534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCCC2=CC=CC=C2)C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1C[NH+](CC[NH+]1CCCC2=CC=CC=C2)C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C23H34N2/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/h1-3,5-6,19-23H,4,7-17H2/p+2