2-(3,5-dimethylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)COC3=CC(=CC(=C3)C)C

InChI

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