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

Systemtic Name: 3-[(4-chloranyl-2,6-dimethyl-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 3-[(4-chloro-2,6-dimethyl-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 3-[(4-chloro-2,6-dimethylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(4-chloro-2,6-dimethylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 3-[(4-chloro-2,6-dimethyl-phenoxy)methyl]-2-furoic acid Formula: C14H13ClO4 MolecularWeight: 280.70362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClO4/c1-8-5-11(15)6-9(2)12(8)19-7-10-3-4-18-13(10)14(16)17/h3-6H,7H2,1-2H3,(H,16,17)