5-methyl-4-[(3-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 5-methyl-4-[(3-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid Openeye Name: 4-[(3-isopropylphenoxy)methyl]-5-methyl-furan-2-carboxylic acid CAS Name: 5-methyl-4-[(3-propan-2-ylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-methyl-4-[(3-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 4-[(3-isopropylphenoxy)methyl]-5-methyl-2-furoic acid Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)COC2=CC=CC(=C2)C(C)C

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)COC2=CC=CC(=C2)C(C)C

InChI

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