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

Systemtic Name: 5-[(4-bromanyl-2-propan-2-yl-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(4-bromo-2-isopropyl-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(4-bromo-2-propan-2-ylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-bromo-2-propan-2-ylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(4-bromo-2-isopropyl-phenoxy)methyl]-2-furoic acid Formula: C15H15BrO4 MolecularWeight: 339.1812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrO4/c1-9(2)12-7-10(16)3-5-13(12)19-8-11-4-6-14(20-11)15(17)18/h3-7,9H,8H2,1-2H3,(H,17,18)