(2R)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanenitrile

Systemtic Name: (2R)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanenitrile Openeye Name: (2R)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile CAS Name: (2R)-2-phenyl-2-(4-phenyl-1-piperazin-1-iumyl)acetonitrile IUPAC Name: (2R)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile Traditional Name: (2R)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetonitrile Formula: C18H20N3+ MolecularWeight: 278.3715

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3/c19-15-18(16-7-3-1-4-8-16)21-13-11-20(12-14-21)17-9-5-2-6-10-17/h1-10,18H,11-14H2/p+1/t18-/m0/s1