(2R)-2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethanenitrile

Systemtic Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethanenitrile Openeye Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)acetonitrile CAS Name: (2R)-2-(4-phenyl-1-piperazin-1-iumyl)-2-(3-pyridinyl)acetonitrile IUPAC Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-ylacetonitrile Traditional Name: (2R)-2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)acetonitrile Formula: C17H19N4+ MolecularWeight: 279.35956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C#N)C2=CN=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1[C@@H](C#N)C2=CN=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4/c18-13-17(15-5-4-8-19-14-15)21-11-9-20(10-12-21)16-6-2-1-3-7-16/h1-8,14,17H,9-12H2/p+1/t17-/m0/s1