2-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]amino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]acetamide Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O2/c1-17-13-18(2)23(19(3)14-17)25-21(28)15-24-22(29)16-26-9-11-27(12-10-26)20-7-5-4-6-8-20/h4-8,13-14H,9-12,15-16H2,1-3H3,(H,24,29)(H,25,28)/p+1