2-acetyloxy-5-octanoyl-benzoic acid

Systemtic Name: 2-acetyloxy-5-octanoyl-benzoic acid Openeye Name: 2-acetoxy-5-octanoyl-benzoic acid CAS Name: 2-acetyloxy-5-(1-oxooctyl)benzoic acid IUPAC Name: 2-acetyloxy-5-octanoylbenzoic acid Traditional Name: 2-acetoxy-5-caprylyl-benzoic acid Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC(=C(C=C1)OC(=O)C)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)C1=CC(=C(C=C1)OC(=O)C)C(=O)O

InChI

InChI=1S/C17H22O5/c1-3-4-5-6-7-8-15(19)13-9-10-16(22-12(2)18)14(11-13)17(20)21/h9-11H,3-8H2,1-2H3,(H,20,21)