4-chloranyl-2-(phenylcarbonyl)hexanoic acid

Systemtic Name: 4-chloranyl-2-(phenylcarbonyl)hexanoic acid Openeye Name: 2-benzoyl-4-chloro-hexanoic acid CAS Name: 2-benzoyl-4-chlorohexanoic acid IUPAC Name: 2-benzoyl-4-chlorohexanoic acid Traditional Name: 2-benzoyl-4-chloro-hexanoic acid Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(=O)C1=CC=CC=C1)C(=O)O)Cl

Isomeric SMILES

CCC(CC(C(=O)C1=CC=CC=C1)C(=O)O)Cl

InChI

InChI=1S/C13H15ClO3/c1-2-10(14)8-11(13(16)17)12(15)9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3,(H,16,17)