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

Systemtic Name: 4-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C22H27N4O4+ MolecularWeight: 411.47418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N4O4/c1-16(27)26-13-11-25(12-14-26)15-21(28)23-18-5-3-17(4-6-18)22(29)24-19-7-9-20(30-2)10-8-19/h3-10H,11-15H2,1-2H3,(H,23,28)(H,24,29)/p+1