2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[(2S)-2-phenylbutyl]ethanamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-[(2S)-2-phenylbutyl]ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[(2S)-2-phenylbutyl]acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[(2S)-2-phenylbutyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[(2S)-2-phenylbutyl]acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[(2S)-2-phenylbutyl]acetamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C[NH+]1CCN(CC1)C(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](CNC(=O)C[NH+]1CCN(CC1)C(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C18H27N3O2/c1-3-16(17-7-5-4-6-8-17)13-19-18(23)14-20-9-11-21(12-10-20)15(2)22/h4-8,16H,3,9-14H2,1-2H3,(H,19,23)/p+1/t16-/m1/s1