5-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(2,3,5-trimethylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(2,3,5-trimethylphenoxy)methyl]-2-furoate Formula: C15H15O4- MolecularWeight: 259.2772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC2=CC=C(O2)C(=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC2=CC=C(O2)C(=O)[O-])C)C

InChI

InChI=1S/C15H16O4/c1-9-6-10(2)11(3)14(7-9)18-8-12-4-5-13(19-12)15(16)17/h4-7H,8H2,1-3H3,(H,16,17)/p-1