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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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