4-[(4-phenylphenoxy)methyl]-5-propan-2-yl-furan-2-carboxylic acid

Systemtic Name: 4-[(4-phenylphenoxy)methyl]-5-propan-2-yl-furan-2-carboxylic acid Openeye Name: 5-isopropyl-4-[(4-phenylphenoxy)methyl]furan-2-carboxylic acid CAS Name: 4-[(4-phenylphenoxy)methyl]-5-propan-2-yl-2-furancarboxylic acid IUPAC Name: 4-[(4-phenylphenoxy)methyl]-5-propan-2-ylfuran-2-carboxylic acid Traditional Name: 5-isopropyl-4-[(4-phenylphenoxy)methyl]-2-furoic acid Formula: C21H20O4 MolecularWeight: 336.3811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(O1)C(=O)O)COC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C=C(O1)C(=O)O)COC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20O4/c1-14(2)20-17(12-19(25-20)21(22)23)13-24-18-10-8-16(9-11-18)15-6-4-3-5-7-15/h3-12,14H,13H2,1-2H3,(H,22,23)