3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]carbonylbenzoic acid

Systemtic Name: 3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]carbonylbenzoic acid Openeye Name: 3-[4-acetoxy-3,5-bis(acetoxymethyl)benzoyl]benzoic acid CAS Name: 3-[[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]-oxomethyl]benzoic acid IUPAC Name: 3-[4-acetyloxy-3,5-bis(acetyloxymethyl)benzoyl]benzoic acid Traditional Name: 3-[4-acetoxy-3,5-bis(acetoxymethyl)benzoyl]benzoic acid Formula: C22H20O9 MolecularWeight: 428.3888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC(=CC(=C1OC(=O)C)COC(=O)C)C(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)OCC1=CC(=CC(=C1OC(=O)C)COC(=O)C)C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C22H20O9/c1-12(23)29-10-18-8-17(20(26)15-5-4-6-16(7-15)22(27)28)9-19(11-30-13(2)24)21(18)31-14(3)25/h4-9H,10-11H2,1-3H3,(H,27,28)