2-[2-(2-carboxy-4-ethynoxy-phenyl)carbonyloxypropan-2-ylperoxymethyl]-5-(2-phenoxyethoxy)benzoic acid

Systemtic Name: 2-[2-(2-carboxy-4-ethynoxy-phenyl)carbonyloxypropan-2-ylperoxymethyl]-5-(2-phenoxyethoxy)benzoic acid Openeye Name: 2-[[1-(2-carboxy-4-ethynoxy-benzoyl)oxy-1-methyl-ethyl]peroxymethyl]-5-(2-phenoxyethoxy)benzoic acid CAS Name: 2-[2-[(2-carboxy-4-ethynoxyphenyl)-oxomethoxy]propan-2-yldioxymethyl]-5-(2-phenoxyethoxy)benzoic acid IUPAC Name: 2-[2-(2-carboxy-4-ethynoxybenzoyl)oxypropan-2-ylperoxymethyl]-5-(2-phenoxyethoxy)benzoic acid Traditional Name: 2-[[1-(2-carboxy-4-ethynoxy-benzoyl)oxy-1-methyl-ethyl]peroxymethyl]-5-(2-phenoxyethoxy)benzoic acid Formula: C29H26O11 MolecularWeight: 550.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(OC(=O)C1=C(C=C(C=C1)OC#C)C(=O)O)OOCC2=C(C=C(C=C2)OCCOC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(OC(=O)C1=C(C=C(C=C1)OC#C)C(=O)O)OOCC2=C(C=C(C=C2)OCCOC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C29H26O11/c1-4-35-21-12-13-23(25(17-21)27(32)33)28(34)39-29(2,3)40-38-18-19-10-11-22(16-24(19)26(30)31)37-15-14-36-20-8-6-5-7-9-20/h1,5-13,16-17H,14-15,18H2,2-3H3,(H,30,31)(H,32,33)