(2S)-2-[bis(cyanomethyl)azaniumyl]propanoate

Systemtic Name: (2S)-2-[bis(cyanomethyl)azaniumyl]propanoate Openeye Name: (2S)-2-[bis(cyanomethyl)ammonio]propanoate CAS Name: (2S)-2-[bis(cyanomethyl)ammonio]propanoate IUPAC Name: (2S)-2-[bis(cyanomethyl)azaniumyl]propanoate Traditional Name: (2S)-2-[bis(cyanomethyl)ammonio]propionate Formula: C7H9N3O2 MolecularWeight: 167.16526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+](CC#N)CC#N

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH+](CC#N)CC#N

InChI

InChI=1S/C7H9N3O2/c1-6(7(11)12)10(4-2-8)5-3-9/h6H,4-5H2,1H3,(H,11,12)/t6-/m0/s1