3-(3-chlorophenyl)-3-hexanoyloxy-propanoic acid

Systemtic Name: 3-(3-chlorophenyl)-3-hexanoyloxy-propanoic acid Openeye Name: 3-(3-chlorophenyl)-3-hexanoyloxy-propanoic acid CAS Name: 3-(3-chlorophenyl)-3-(1-oxohexoxy)propanoic acid IUPAC Name: 3-(3-chlorophenyl)-3-hexanoyloxypropanoic acid Traditional Name: 3-caproyloxy-3-(3-chlorophenyl)propionic acid Formula: C15H19ClO4 MolecularWeight: 298.76196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CC(=O)O)C1=CC(=CC=C1)Cl

Isomeric SMILES

CCCCCC(=O)OC(CC(=O)O)C1=CC(=CC=C1)Cl

InChI

InChI=1S/C15H19ClO4/c1-2-3-4-8-15(19)20-13(10-14(17)18)11-6-5-7-12(16)9-11/h5-7,9,13H,2-4,8,10H2,1H3,(H,17,18)