3-[(4-hydroxyphenyl)sulfanylmethyl]-3-methanoyl-5-methyl-hexanoic acid

Systemtic Name: 3-[(4-hydroxyphenyl)sulfanylmethyl]-3-methanoyl-5-methyl-hexanoic acid Openeye Name: 3-formyl-3-[(4-hydroxyphenyl)sulfanylmethyl]-5-methyl-hexanoic acid CAS Name: 3-formyl-3-[[(4-hydroxyphenyl)thio]methyl]-5-methylhexanoic acid IUPAC Name: 3-formyl-3-[(4-hydroxyphenyl)sulfanylmethyl]-5-methylhexanoic acid Traditional Name: 3-formyl-3-[[(4-hydroxyphenyl)thio]methyl]-5-methyl-hexanoic acid Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)(CSC1=CC=C(C=C1)O)C=O

Isomeric SMILES

CC(C)CC(CC(=O)O)(CSC1=CC=C(C=C1)O)C=O

InChI

InChI=1S/C15H20O4S/c1-11(2)7-15(9-16,8-14(18)19)10-20-13-5-3-12(17)4-6-13/h3-6,9,11,17H,7-8,10H2,1-2H3,(H,18,19)