2-methoxycarbonyl-2-oxidanyl-4-pyridin-4-yl-butanoic acid

Systemtic Name: 2-methoxycarbonyl-2-oxidanyl-4-pyridin-4-yl-butanoic acid Openeye Name: 2-hydroxy-2-methoxycarbonyl-4-(4-pyridyl)butanoic acid CAS Name: 2-hydroxy-2-methoxycarbonyl-4-pyridin-4-ylbutanoic acid IUPAC Name: 2-hydroxy-2-methoxycarbonyl-4-pyridin-4-ylbutanoic acid Traditional Name: 2-carbomethoxy-2-hydroxy-4-(4-pyridyl)butyric acid Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1=CC=NC=C1)(C(=O)O)O

Isomeric SMILES

COC(=O)C(CCC1=CC=NC=C1)(C(=O)O)O

InChI

InChI=1S/C11H13NO5/c1-17-10(15)11(16,9(13)14)5-2-8-3-6-12-7-4-8/h3-4,6-7,16H,2,5H2,1H3,(H,13,14)