(2S)-2-pyrrolidin-1-ium-1-ylpropanenitrile

Systemtic Name: (2S)-2-pyrrolidin-1-ium-1-ylpropanenitrile Openeye Name: (2S)-2-pyrrolidin-1-ium-1-ylpropanenitrile CAS Name: (2S)-2-(1-pyrrolidin-1-iumyl)propanenitrile IUPAC Name: (2S)-2-pyrrolidin-1-ium-1-ylpropanenitrile Traditional Name: (2S)-2-pyrrolidin-1-ium-1-ylpropionitrile Formula: C7H13N2+ MolecularWeight: 125.19152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)[NH+]1CCCC1

Isomeric SMILES

C[C@@H](C#N)[NH+]1CCCC1

InChI

InChI=1S/C7H12N2/c1-7(6-8)9-4-2-3-5-9/h7H,2-5H2,1H3/p+1/t7-/m0/s1