2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[3-(2,3,5-trimethylphenoxy)propyl]ethanamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[3-(2,3,5-trimethylphenoxy)propyl]ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[3-(2,3,5-trimethylphenoxy)propyl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[3-(2,3,5-trimethylphenoxy)propyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[3-(2,3,5-trimethylphenoxy)propyl]acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[3-(2,3,5-trimethylphenoxy)propyl]acetamide Formula: C20H32N3O3+ MolecularWeight: 362.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCNC(=O)C[NH+]2CCN(CC2)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCNC(=O)C[NH+]2CCN(CC2)C(=O)C)C)C

InChI

InChI=1S/C20H31N3O3/c1-15-12-16(2)17(3)19(13-15)26-11-5-6-21-20(25)14-22-7-9-23(10-8-22)18(4)24/h12-13H,5-11,14H2,1-4H3,(H,21,25)/p+1