3-oxidanylidene-2-[4-(pyridin-3-ylmethyl)phenoxy]butanoic acid

Systemtic Name: 3-oxidanylidene-2-[4-(pyridin-3-ylmethyl)phenoxy]butanoic acid Openeye Name: 3-oxo-2-[4-(3-pyridylmethyl)phenoxy]butanoic acid CAS Name: 3-oxo-2-[4-(3-pyridinylmethyl)phenoxy]butanoic acid IUPAC Name: 3-oxo-2-[4-(pyridin-3-ylmethyl)phenoxy]butanoic acid Traditional Name: 3-keto-2-[4-(3-pyridylmethyl)phenoxy]butyric acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)O)OC1=CC=C(C=C1)CC2=CN=CC=C2

Isomeric SMILES

CC(=O)C(C(=O)O)OC1=CC=C(C=C1)CC2=CN=CC=C2

InChI

InChI=1S/C16H15NO4/c1-11(18)15(16(19)20)21-14-6-4-12(5-7-14)9-13-3-2-8-17-10-13/h2-8,10,15H,9H2,1H3,(H,19,20)