4-[(2R)-6-methyl-2,6-bis(oxidanyl)heptan-2-yl]-3-oxidanyl-benzoate

Systemtic Name: 4-[(2R)-6-methyl-2,6-bis(oxidanyl)heptan-2-yl]-3-oxidanyl-benzoate Openeye Name: 4-[(1R)-1,5-dihydroxy-1,5-dimethyl-hexyl]-3-hydroxy-benzoate CAS Name: 4-[(2R)-2,6-dihydroxy-6-methylheptan-2-yl]-3-hydroxybenzoate IUPAC Name: 4-[(2R)-2,6-dihydroxy-6-methylheptan-2-yl]-3-hydroxybenzoate Traditional Name: 4-[(1R)-1,5-dihydroxy-1,5-dimethyl-hexyl]-3-hydroxy-benzoate Formula: C15H21O5- MolecularWeight: 281.32424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C)(C1=C(C=C(C=C1)C(=O)[O-])O)O)O

Isomeric SMILES

C[C@@](CCCC(C)(C)O)(C1=C(C=C(C=C1)C(=O)[O-])O)O

InChI

InChI=1S/C15H22O5/c1-14(2,19)7-4-8-15(3,20)11-6-5-10(13(17)18)9-12(11)16/h5-6,9,16,19-20H,4,7-8H2,1-3H3,(H,17,18)/p-1/t15-/m1/s1