4-acetyloxy-3-propyl-benzoic acid

Systemtic Name: 4-acetyloxy-3-propyl-benzoic acid Openeye Name: 4-acetoxy-3-propyl-benzoic acid CAS Name: 4-acetyloxy-3-propylbenzoic acid IUPAC Name: 4-acetyloxy-3-propylbenzoic acid Traditional Name: 4-acetoxy-3-propyl-benzoic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)O)OC(=O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)O)OC(=O)C

InChI

InChI=1S/C12H14O4/c1-3-4-9-7-10(12(14)15)5-6-11(9)16-8(2)13/h5-7H,3-4H2,1-2H3,(H,14,15)