5-[(2-bromanyl-4-methyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(2-bromanyl-4-methyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(2-bromo-4-methyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(2-bromo-4-methylphenoxy)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(2-bromo-4-methylphenoxy)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(2-bromo-4-methyl-phenoxy)methyl]-2-methyl-3-furoic acid Formula: C14H13BrO4 MolecularWeight: 325.15462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC(=C(O2)C)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC(=C(O2)C)C(=O)O)Br

InChI

InChI=1S/C14H13BrO4/c1-8-3-4-13(12(15)5-8)18-7-10-6-11(14(16)17)9(2)19-10/h3-6H,7H2,1-2H3,(H,16,17)