3-oxidanylidene-2-phenethyl-2-[3-(pyridin-3-ylmethoxy)phenoxy]butanoic acid

Systemtic Name: 3-oxidanylidene-2-phenethyl-2-[3-(pyridin-3-ylmethoxy)phenoxy]butanoic acid Openeye Name: 3-oxo-2-phenethyl-2-[3-(3-pyridylmethoxy)phenoxy]butanoic acid CAS Name: 3-oxo-2-phenethyl-2-[3-(3-pyridinylmethoxy)phenoxy]butanoic acid IUPAC Name: 3-oxo-2-phenethyl-2-[3-(pyridin-3-ylmethoxy)phenoxy]butanoic acid Traditional Name: 3-keto-2-phenethyl-2-[3-(3-pyridylmethoxy)phenoxy]butyric acid Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC=CC=C1)(C(=O)O)OC2=CC=CC(=C2)OCC3=CN=CC=C3

Isomeric SMILES

CC(=O)C(CCC1=CC=CC=C1)(C(=O)O)OC2=CC=CC(=C2)OCC3=CN=CC=C3

InChI

InChI=1S/C24H23NO5/c1-18(26)24(23(27)28,13-12-19-7-3-2-4-8-19)30-22-11-5-10-21(15-22)29-17-20-9-6-14-25-16-20/h2-11,14-16H,12-13,17H2,1H3,(H,27,28)