5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate Openeye Name: 5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate CAS Name: 5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-methyl-4-[(2,3,5-trimethylphenoxy)methyl]-2-furoate Formula: C16H17O4- MolecularWeight: 273.30378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC2=C(OC(=C2)C(=O)[O-])C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC2=C(OC(=C2)C(=O)[O-])C)C)C

InChI

InChI=1S/C16H18O4/c1-9-5-10(2)11(3)14(6-9)19-8-13-7-15(16(17)18)20-12(13)4/h5-7H,8H2,1-4H3,(H,17,18)/p-1