5-[1-(2,4-dimethylphenyl)ethyl]furan-2-carboxylate

Systemtic Name: 5-[1-(2,4-dimethylphenyl)ethyl]furan-2-carboxylate Openeye Name: 5-[1-(2,4-dimethylphenyl)ethyl]furan-2-carboxylate CAS Name: 5-[1-(2,4-dimethylphenyl)ethyl]-2-furancarboxylate IUPAC Name: 5-[1-(2,4-dimethylphenyl)ethyl]furan-2-carboxylate Traditional Name: 5-[1-(2,4-dimethylphenyl)ethyl]-2-furoate Formula: C15H15O3- MolecularWeight: 243.2778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16O3/c1-9-4-5-12(10(2)8-9)11(3)13-6-7-14(18-13)15(16)17/h4-8,11H,1-3H3,(H,16,17)/p-1