3-[3-[5-(oxan-2-yloxymethyl)-1,2-oxazol-3-yl]phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-[5-(oxan-2-yloxymethyl)-1,2-oxazol-3-yl]phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-oxo-3-[3-[5-(tetrahydropyran-2-yloxymethyl)isoxazol-3-yl]phenyl]propanoic acid CAS Name: 3-[3-[5-(2-oxanyloxymethyl)-3-isoxazolyl]phenyl]-3-oxopropanoic acid IUPAC Name: 3-[3-[5-(oxan-2-yloxymethyl)-1,2-oxazol-3-yl]phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[3-[5-(tetrahydropyran-2-yloxymethyl)isoxazol-3-yl]phenyl]propionic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC2=CC(=NO2)C3=CC(=CC=C3)C(=O)CC(=O)O

Isomeric SMILES

C1CCOC(C1)OCC2=CC(=NO2)C3=CC(=CC=C3)C(=O)CC(=O)O

InChI

InChI=1S/C18H19NO6/c20-16(10-17(21)22)13-5-3-4-12(8-13)15-9-14(25-19-15)11-24-18-6-1-2-7-23-18/h3-5,8-9,18H,1-2,6-7,10-11H2,(H,21,22)