3-[4-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonylpiperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(1-methyl-2-oxo-pyridine-4-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(1-methyl-2-oxo-4-pyridinyl)-oxomethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(1-methyl-2-oxopyridine-4-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(2-keto-1-methyl-isonicotinoyl)piperazino]propionic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)C(=O)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CN1C=CC(=CC1=O)C(=O)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C14H19N3O4/c1-15-4-2-11(10-12(15)18)14(21)17-8-6-16(7-9-17)5-3-13(19)20/h2,4,10H,3,5-9H2,1H3,(H,19,20)