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

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O3/c1-13-5-4-6-16(14(13)2)20-17(24)11-19-18(25)12-21-7-9-22(10-8-21)15(3)23/h4-6H,7-12H2,1-3H3,(H,19,25)(H,20,24)/p+1