3-[4-(6-oxidanylidenepyran-3-yl)carbonylpiperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(6-oxidanylidenepyran-3-yl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(6-oxopyran-3-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[oxo-(6-oxo-3-pyranyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(6-oxopyran-3-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(6-ketopyran-3-carbonyl)piperazino]propionic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)C2=COC(=O)C=C2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)C2=COC(=O)C=C2

InChI

InChI=1S/C13H16N2O5/c16-11(17)3-4-14-5-7-15(8-6-14)13(19)10-1-2-12(18)20-9-10/h1-2,9H,3-8H2,(H,16,17)