N-[4-(diethylamino)phenyl]-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(diethylamino)phenyl]-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-[4-(diethylamino)phenyl]-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-[4-(diethylamino)phenyl]-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-[4-(diethylamino)phenyl]-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-[4-(diethylamino)phenyl]-2-piperazin-1-ium-1-yl-acetamide Formula: C16H27N4O+ MolecularWeight: 291.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O/c1-3-20(4-2)15-7-5-14(6-8-15)18-16(21)13-19-11-9-17-10-12-19/h5-8,17H,3-4,9-13H2,1-2H3,(H,18,21)/p+1