2-(1-adamantyl)-N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[3-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C24H35ClN3O+ MolecularWeight: 417.0072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34ClN3O/c1-2-27-6-8-28(9-7-27)23-20(25)4-3-5-21(23)26-22(29)16-24-13-17-10-18(14-24)12-19(11-17)15-24/h3-5,17-19H,2,6-16H2,1H3,(H,26,29)/p+1