(2R)-2-piperazin-4-ium-1-yl-2-(4-propylphenyl)propanenitrile

Systemtic Name: (2R)-2-piperazin-4-ium-1-yl-2-(4-propylphenyl)propanenitrile Openeye Name: (2R)-2-piperazin-4-ium-1-yl-2-(4-propylphenyl)propanenitrile CAS Name: (2R)-2-(1-piperazin-4-iumyl)-2-(4-propylphenyl)propanenitrile IUPAC Name: (2R)-2-piperazin-4-ium-1-yl-2-(4-propylphenyl)propanenitrile Traditional Name: (2R)-2-piperazin-4-ium-1-yl-2-(4-propylphenyl)propionitrile Formula: C16H24N3+ MolecularWeight: 258.38186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C)(C#N)N2CC[NH2+]CC2

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@](C)(C#N)N2CC[NH2+]CC2

InChI

InChI=1S/C16H23N3/c1-3-4-14-5-7-15(8-6-14)16(2,13-17)19-11-9-18-10-12-19/h5-8,18H,3-4,9-12H2,1-2H3/p+1/t16-/m0/s1