3-[4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(6-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[oxo-(6-oxo-1H-pyridin-3-yl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(6-keto-1H-pyridine-3-carbonyl)piperazino]propionic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c17-11-2-1-10(9-14-11)13(20)16-7-5-15(6-8-16)4-3-12(18)19/h1-2,9H,3-8H2,(H,14,17)(H,18,19)