4-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H24N4O3/c1-15(26)16-4-8-19(9-5-16)25-12-10-24(11-13-25)14-20(27)23-18-6-2-17(3-7-18)21(22)28/h2-9H,10-14H2,1H3,(H2,22,28)(H,23,27)/p+1