ethyl 3-[4-(2-adamantyl)piperazine-1,4-diium-1-yl]propanoate

Systemtic Name: ethyl 3-[4-(2-adamantyl)piperazine-1,4-diium-1-yl]propanoate Openeye Name: ethyl 3-[4-(2-adamantyl)piperazine-1,4-diium-1-yl]propanoate CAS Name: 3-[4-(2-adamantyl)-1-piperazine-1,4-diiumyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(2-adamantyl)piperazine-1,4-diium-1-yl]propanoate Traditional Name: 3-[4-(2-adamantyl)piperazine-1,4-diium-1-yl]propionic acid ethyl ester Formula: C19H34N2O2+2 MolecularWeight: 322.48546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC[NH+]1CC[NH+](CC1)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCOC(=O)CC[NH+]1CC[NH+](CC1)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C19H32N2O2/c1-2-23-18(22)3-4-20-5-7-21(8-6-20)19-16-10-14-9-15(12-16)13-17(19)11-14/h14-17,19H,2-13H2,1H3/p+2