3-[(4-bromanyl-2-chloranyl-6-methyl-phenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 3-[(4-bromanyl-2-chloranyl-6-methyl-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 3-[(4-bromo-2-chloro-6-methyl-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 3-[(4-bromo-2-chloro-6-methylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(4-bromo-2-chloro-6-methylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 3-[(4-bromo-2-chloro-6-methyl-phenoxy)methyl]-2-furoic acid Formula: C13H10BrClO4 MolecularWeight: 345.5731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=C(OC=C2)C(=O)O)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=C(OC=C2)C(=O)O)Cl)Br

InChI

InChI=1S/C13H10BrClO4/c1-7-4-9(14)5-10(15)11(7)19-6-8-2-3-18-12(8)13(16)17/h2-5H,6H2,1H3,(H,16,17)