2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-prop-2-ynyl-acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-N-prop-2-ynylacetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-prop-2-ynylacetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-propargyl-acetamide Formula: C16H23N3O+2 MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

C#CCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O/c1-2-8-17-16(20)14-19-11-9-18(10-12-19)13-15-6-4-3-5-7-15/h1,3-7H,8-14H2,(H,17,20)/p+2