2-(4-oxidanyl-3-prop-2-enyl-phenyl)sulfanylethanoic acid

Systemtic Name: 2-(4-oxidanyl-3-prop-2-enyl-phenyl)sulfanylethanoic acid Openeye Name: 2-(3-allyl-4-hydroxy-phenyl)sulfanylacetic acid CAS Name: 2-[(4-hydroxy-3-prop-2-enylphenyl)thio]acetic acid IUPAC Name: 2-(4-hydroxy-3-prop-2-enylphenyl)sulfanylacetic acid Traditional Name: 2-[(3-allyl-4-hydroxy-phenyl)thio]acetic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O3S/c1-2-3-8-6-9(4-5-10(8)12)15-7-11(13)14/h2,4-6,12H,1,3,7H2,(H,13,14)