(2S)-2-[[(2S)-2-azanylpropanoyl]amino]propanoic acid dihydrate

Systemtic Name: (2S)-2-[[(2S)-2-azanylpropanoyl]amino]propanoic acid dihydrate Openeye Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoic acid dihydrate CAS Name: (2S)-2-[[(2S)-2-amino-1-oxopropyl]amino]propanoic acid dihydrate IUPAC Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoic acid dihydrate Traditional Name: (2S)-2-[[(2S)-2-aminopropanoyl]amino]propionic acid dihydrate Formula: C6H16N2O5 MolecularWeight: 196.20164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)O)N.O.O

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](C)C(=O)O)N.O.O

InChI

InChI=1S/C6H12N2O3.2H2O/c1-3(7)5(9)8-4(2)6(10)11;;/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11);2*1H2/t3-,4-;;/m0../s1