N-(2,3-dimethylphenyl)-2-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: 2-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[[2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[[2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C

InChI

InChI=1S/C24H30N4O3/c1-17-5-4-6-22(18(17)2)26-23(30)15-25-24(31)16-27-11-13-28(14-12-27)21-9-7-20(8-10-21)19(3)29/h4-10H,11-16H2,1-3H3,(H,25,31)(H,26,30)/p+1