N-(cyclohexylcarbamoyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(cyclohexylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C21H30N4O3/c1-16(26)17-7-9-19(10-8-17)25-13-11-24(12-14-25)15-20(27)23-21(28)22-18-5-3-2-4-6-18/h7-10,18H,2-6,11-15H2,1H3,(H2,22,23,27,28)/p+1