N-methyl-N-phenyl-2-piperazine-1,4-diium-1-yl-ethanamide

Systemtic Name: N-methyl-N-phenyl-2-piperazine-1,4-diium-1-yl-ethanamide Openeye Name: N-methyl-N-phenyl-2-piperazine-1,4-diium-1-yl-acetamide CAS Name: N-methyl-N-phenyl-2-(1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-methyl-N-phenyl-2-piperazine-1,4-diium-1-ylacetamide Traditional Name: N-methyl-N-phenyl-2-piperazine-1,4-diium-1-yl-acetamide Formula: C13H21N3O+2 MolecularWeight: 235.32534

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C[NH+]2CC[NH2+]CC2

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)C[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C13H19N3O/c1-15(12-5-3-2-4-6-12)13(17)11-16-9-7-14-8-10-16/h2-6,14H,7-11H2,1H3/p+2