[5-(2-butanoyloxy-1-oxidanyl-ethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 2-acetyloxybenzoate

Systemtic Name: [5-(2-butanoyloxy-1-oxidanyl-ethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 2-acetyloxybenzoate Openeye Name: [5-(2-butanoyloxy-1-hydroxy-ethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [5-[1-hydroxy-2-(1-oxobutoxy)ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl ester IUPAC Name: [5-(2-butanoyloxy-1-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [5-(2-butyryloxy-1-hydroxy-ethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl ester Formula: C21H28O9 MolecularWeight: 424.44162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(C1C(OC(O1)(C)C)COC(=O)C2=CC=CC=C2OC(=O)C)O

Isomeric SMILES

CCCC(=O)OCC(C1C(OC(O1)(C)C)COC(=O)C2=CC=CC=C2OC(=O)C)O

InChI

InChI=1S/C21H28O9/c1-5-8-18(24)26-11-15(23)19-17(29-21(3,4)30-19)12-27-20(25)14-9-6-7-10-16(14)28-13(2)22/h6-7,9-10,15,17,19,23H,5,8,11-12H2,1-4H3