[1,3-bis(oxidanyl)-2-phenyl-propyl] 2-methylpropanoate

Systemtic Name: [1,3-bis(oxidanyl)-2-phenyl-propyl] 2-methylpropanoate Openeye Name: (1,3-dihydroxy-2-phenyl-propyl) 2-methylpropanoate CAS Name: 2-methylpropanoic acid (1,3-dihydroxy-2-phenylpropyl) ester IUPAC Name: (1,3-dihydroxy-2-phenylpropyl) 2-methylpropanoate Traditional Name: 2-methylpropionic acid (1,3-dihydroxy-2-phenyl-propyl) ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O4/c1-9(2)12(15)17-13(16)11(8-14)10-6-4-3-5-7-10/h3-7,9,11,13-14,16H,8H2,1-2H3