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

Systemtic Name: 2-[4-chloranyl-2-(3-cyano-5-methyl-phenyl)carbonyl-phenoxy]ethanoic acid Openeye Name: 2-[4-chloro-2-(3-cyano-5-methyl-benzoyl)phenoxy]acetic acid CAS Name: 2-[4-chloro-2-[(3-cyano-5-methylphenyl)-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[4-chloro-2-(3-cyano-5-methylbenzoyl)phenoxy]acetic acid Traditional Name: 2-[4-chloro-2-(3-cyano-5-methyl-benzoyl)phenoxy]acetic acid Formula: C17H12ClNO4 MolecularWeight: 329.73448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C=CC(=C2)Cl)OCC(=O)O)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C=CC(=C2)Cl)OCC(=O)O)C#N

InChI

InChI=1S/C17H12ClNO4/c1-10-4-11(8-19)6-12(5-10)17(22)14-7-13(18)2-3-15(14)23-9-16(20)21/h2-7H,9H2,1H3,(H,20,21)