N-(2,6-diethylphenyl)-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-piperazin-1-ium-1-yl-acetamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCNCC2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCNCC2

InChI

InChI=1S/C16H25N3O/c1-3-13-6-5-7-14(4-2)16(13)18-15(20)12-19-10-8-17-9-11-19/h5-7,17H,3-4,8-12H2,1-2H3,(H,18,20)/p+1