[4-methyl-3,4-bis(oxidanyl)pentyl] 3-phenylpropanoate

Systemtic Name: [4-methyl-3,4-bis(oxidanyl)pentyl] 3-phenylpropanoate Openeye Name: (3,4-dihydroxy-4-methyl-pentyl) 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid (3,4-dihydroxy-4-methylpentyl) ester IUPAC Name: (3,4-dihydroxy-4-methylpentyl) 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid (3,4-dihydroxy-4-methyl-pentyl) ester Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCOC(=O)CCC1=CC=CC=C1)O)O

Isomeric SMILES

CC(C)(C(CCOC(=O)CCC1=CC=CC=C1)O)O

InChI

InChI=1S/C15H22O4/c1-15(2,18)13(16)10-11-19-14(17)9-8-12-6-4-3-5-7-12/h3-7,13,16,18H,8-11H2,1-2H3