2-(2,3-dimethylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(2,3-dimethylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(2,3-dimethylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(2,3-dimethylphenoxy)-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=CC=CC(=C3C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=CC=CC(=C3C)C

InChI

InChI=1S/C22H29N3O2/c1-4-24-12-14-25(15-13-24)20-10-8-19(9-11-20)23-22(26)16-27-21-7-5-6-17(2)18(21)3/h5-11H,4,12-16H2,1-3H3,(H,23,26)/p+1