5-[(2-butan-2-ylphenoxy)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(2-butan-2-ylphenoxy)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 2-methyl-5-[(2-sec-butylphenoxy)methyl]furan-3-carboxylic acid CAS Name: 5-[(2-butan-2-ylphenoxy)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(2-butan-2-ylphenoxy)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 2-methyl-5-[(2-sec-butylphenoxy)methyl]-3-furoic acid Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC2=CC(=C(O2)C)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC2=CC(=C(O2)C)C(=O)O

InChI

InChI=1S/C17H20O4/c1-4-11(2)14-7-5-6-8-16(14)20-10-13-9-15(17(18)19)12(3)21-13/h5-9,11H,4,10H2,1-3H3,(H,18,19)