(2R)-3-methyl-2-piperazin-4-ium-1-yl-butanenitrile

Systemtic Name: (2R)-3-methyl-2-piperazin-4-ium-1-yl-butanenitrile Openeye Name: (2R)-3-methyl-2-piperazin-4-ium-1-yl-butanenitrile CAS Name: (2R)-3-methyl-2-(1-piperazin-4-iumyl)butanenitrile IUPAC Name: (2R)-3-methyl-2-piperazin-4-ium-1-ylbutanenitrile Traditional Name: (2R)-3-methyl-2-piperazin-4-ium-1-yl-butyronitrile Formula: C9H18N3+ MolecularWeight: 168.25932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)N1CC[NH2+]CC1

Isomeric SMILES

CC(C)[C@H](C#N)N1CC[NH2+]CC1

InChI

InChI=1S/C9H17N3/c1-8(2)9(7-10)12-5-3-11-4-6-12/h8-9,11H,3-6H2,1-2H3/p+1/t9-/m0/s1