(2R)-2-phenyl-2-piperazine-1,4-diium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-phenyl-2-piperazine-1,4-diium-1-yl-ethanenitrile Openeye Name: (2R)-2-phenyl-2-piperazine-1,4-diium-1-yl-acetonitrile CAS Name: (2R)-2-phenyl-2-(1-piperazine-1,4-diiumyl)acetonitrile IUPAC Name: (2R)-2-phenyl-2-piperazine-1,4-diium-1-ylacetonitrile Traditional Name: (2R)-2-phenyl-2-piperazine-1,4-diium-1-yl-acetonitrile Formula: C12H17N3+2 MolecularWeight: 203.28348

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)C(C#N)C2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CC[NH2+]1)[C@@H](C#N)C2=CC=CC=C2

InChI

InChI=1S/C12H15N3/c13-10-12(11-4-2-1-3-5-11)15-8-6-14-7-9-15/h1-5,12,14H,6-9H2/p+2/t12-/m0/s1