2-piperazin-1-ylpropanoic acid dihydrate

Systemtic Name: 2-piperazin-1-ylpropanoic acid dihydrate Openeye Name: 2-piperazin-1-ylpropanoic acid dihydrate CAS Name: 2-(1-piperazinyl)propanoic acid dihydrate IUPAC Name: 2-piperazin-1-ylpropanoic acid dihydrate Traditional Name: 2-piperazinopropionic acid dihydrate Formula: C7H18N2O4 MolecularWeight: 194.22882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCNCC1.O.O

Isomeric SMILES

CC(C(=O)O)N1CCNCC1.O.O

InChI

InChI=1S/C7H14N2O2.2H2O/c1-6(7(10)11)9-4-2-8-3-5-9;;/h6,8H,2-5H2,1H3,(H,10,11);2*1H2