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

Systemtic Name: 2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-(4-ethoxyphenyl)benzamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-ethoxyphenyl)benzamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(4-ethoxyphenyl)benzamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-ethoxyphenyl)benzamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-p-phenetyl-benzamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H28N4O4/c1-3-31-19-10-8-18(9-11-19)24-23(30)20-6-4-5-7-21(20)25-22(29)16-26-12-14-27(15-13-26)17(2)28/h4-11H,3,12-16H2,1-2H3,(H,24,30)(H,25,29)/p+1