(2S)-2-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]methyl]pentanedinitrile

Systemtic Name: (2S)-2-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]methyl]pentanedinitrile Openeye Name: (2S)-2-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]methyl]pentanedinitrile CAS Name: (2S)-2-[[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazin-1-iumyl]methyl]pentanedinitrile IUPAC Name: (2S)-2-[[4-[(2R)-oxolane-2-carbonyl]piperazin-1-ium-1-yl]methyl]pentanedinitrile Traditional Name: (2S)-2-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]methyl]glutaronitrile Formula: C15H23N4O2+ MolecularWeight: 291.36872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CC[NH+](CC2)CC(CCC#N)C#N

Isomeric SMILES

C1C[C@@H](OC1)C(=O)N2CC[NH+](CC2)C[C@H](CCC#N)C#N

InChI

InChI=1S/C15H22N4O2/c16-5-1-3-13(11-17)12-18-6-8-19(9-7-18)15(20)14-4-2-10-21-14/h13-14H,1-4,6-10,12H2/p+1/t13-,14-/m1/s1