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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC2=C(OC(=C2)C(=O)O)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC2=C(OC(=C2)C(=O)O)C

InChI

InChI=1S/C15H15BrO4/c1-3-10-6-12(16)4-5-13(10)19-8-11-7-14(15(17)18)20-9(11)2/h4-7H,3,8H2,1-2H3,(H,17,18)