2-[3-(3-cyano-5-fluoranyl-phenoxy)-4-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[3-(3-cyano-5-fluoranyl-phenoxy)-4-methyl-phenyl]ethanoic acid Openeye Name: 2-[3-(3-cyano-5-fluoro-phenoxy)-4-methyl-phenyl]acetic acid CAS Name: 2-[3-(3-cyano-5-fluorophenoxy)-4-methylphenyl]acetic acid IUPAC Name: 2-[3-(3-cyano-5-fluorophenoxy)-4-methylphenyl]acetic acid Traditional Name: 2-[3-(3-cyano-5-fluoro-phenoxy)-4-methyl-phenyl]acetic acid Formula: C16H12FNO3 MolecularWeight: 285.269783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(=O)O)OC2=CC(=CC(=C2)C#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)CC(=O)O)OC2=CC(=CC(=C2)C#N)F

InChI

InChI=1S/C16H12FNO3/c1-10-2-3-11(7-16(19)20)6-15(10)21-14-5-12(9-18)4-13(17)8-14/h2-6,8H,7H2,1H3,(H,19,20)