5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]furan-2-carboxylate Openeye Name: 5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]furan-2-carboxylate CAS Name: 5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]-2-furancarboxylate IUPAC Name: 5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]furan-2-carboxylate Traditional Name: 5-[(1S)-1-(3,4-dimethylphenoxy)ethyl]-2-furoate Formula: C15H15O4- MolecularWeight: 259.2772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C2=CC=C(O2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)O[C@@H](C)C2=CC=C(O2)C(=O)[O-])C

InChI

InChI=1S/C15H16O4/c1-9-4-5-12(8-10(9)2)18-11(3)13-6-7-14(19-13)15(16)17/h4-8,11H,1-3H3,(H,16,17)/p-1/t11-/m0/s1