2-[4-(4-chloranylbutanoyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-chloranylbutanoyl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-chlorobutanoyl)phenyl]acetic acid CAS Name: 2-[4-(4-chloro-1-oxobutyl)phenyl]acetic acid IUPAC Name: 2-[4-(4-chlorobutanoyl)phenyl]acetic acid Traditional Name: 2-[4-(4-chlorobutanoyl)phenyl]acetic acid Formula: C12H13ClO3 MolecularWeight: 240.68282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)C(=O)CCCCl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)C(=O)CCCCl

InChI

InChI=1S/C12H13ClO3/c13-7-1-2-11(14)10-5-3-9(4-6-10)8-12(15)16/h3-6H,1-2,7-8H2,(H,15,16)