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

Systemtic Name: 2-[4-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(1-methyl-2-oxo-pyridine-4-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(1-methyl-2-oxo-4-pyridinyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(1-methyl-2-oxopyridine-4-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2-keto-1-methyl-isonicotinoyl)piperazino]acetic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c1-14-3-2-10(8-11(14)17)13(20)16-6-4-15(5-7-16)9-12(18)19/h2-3,8H,4-7,9H2,1H3,(H,18,19)