N-(3-ethylphenyl)-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-(3-ethylphenyl)-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-(3-ethylphenyl)-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-(3-ethylphenyl)-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-ethylphenyl)-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-(3-ethylphenyl)-2-piperazin-1-ium-1-yl-acetamide Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-2-12-4-3-5-13(10-12)16-14(18)11-17-8-6-15-7-9-17/h3-5,10,15H,2,6-9,11H2,1H3,(H,16,18)/p+1