2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(p-tolylmethyl)benzamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-methylbenzyl)benzamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H28N4O3/c1-17-7-9-19(10-8-17)15-24-23(30)20-5-3-4-6-21(20)25-22(29)16-26-11-13-27(14-12-26)18(2)28/h3-10H,11-16H2,1-2H3,(H,24,30)(H,25,29)/p+1