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

Systemtic Name: N-(4-chlorophenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-chlorophenyl)benzamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(4-chlorophenyl)benzamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-chlorophenyl)benzamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-chlorophenyl)benzamide Formula: C21H24ClN4O3+ MolecularWeight: 415.89326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN4O3/c1-15(27)26-12-10-25(11-13-26)14-20(28)24-19-5-3-2-4-18(19)21(29)23-17-8-6-16(22)7-9-17/h2-9H,10-14H2,1H3,(H,23,29)(H,24,28)/p+1