5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]furan-2-carboxylate Openeye Name: 5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]furan-2-carboxylate CAS Name: 5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-methyl-4-[(2,3,6-trimethylphenoxy)methyl]-2-furoate Formula: C16H17O4- MolecularWeight: 273.30378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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