5-(3-hydroxyphenyl)-5-methyl-hexanoate

Systemtic Name: 5-(3-hydroxyphenyl)-5-methyl-hexanoate Openeye Name: 5-(3-hydroxyphenyl)-5-methyl-hexanoate CAS Name: 5-(3-hydroxyphenyl)-5-methylhexanoate IUPAC Name: 5-(3-hydroxyphenyl)-5-methylhexanoate Traditional Name: 5-(3-hydroxyphenyl)-5-methyl-hexanoate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-13(2,8-4-7-12(15)16)10-5-3-6-11(14)9-10/h3,5-6,9,14H,4,7-8H2,1-2H3,(H,15,16)/p-1