5-[(3-tert-butylphenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(3-tert-butylphenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(3-tert-butylphenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(3-tert-butylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(3-tert-butylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(3-tert-butylphenoxy)methyl]-2-furoic acid Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)OCC2=CC=C(O2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)OCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C16H18O4/c1-16(2,3)11-5-4-6-12(9-11)19-10-13-7-8-14(20-13)15(17)18/h4-9H,10H2,1-3H3,(H,17,18)