N-(2-adamantyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-adamantyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-adamantyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-adamantyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-adamantyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-adamantyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C22H32N3O+ MolecularWeight: 354.50898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2C3CC4CC(C3)CC2C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2C3CC4CC(C3)CC2C4)C5=CC=CC=C5

InChI

InChI=1S/C22H31N3O/c26-21(23-22-18-11-16-10-17(13-18)14-19(22)12-16)15-24-6-8-25(9-7-24)20-4-2-1-3-5-20/h1-5,16-19,22H,6-15H2,(H,23,26)/p+1