N-(2-ethylphenyl)-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]acetamide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2/c1-2-18-8-6-7-11-20(18)24-21(27)16-23-22(28)17-25-12-14-26(15-13-25)19-9-4-3-5-10-19/h3-11H,2,12-17H2,1H3,(H,23,28)(H,24,27)/p+1