(2R)-2-(4-phenylphenyl)-2-piperazin-4-ium-1-yl-ethanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(C#N)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)[C@@H](C#N)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

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