(E)-3-(5-methyl-2-methylsulfanyl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-methyl-2-methylsulfanyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(5-methyl-2-methylsulfanyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-[5-methyl-2-(methylthio)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(5-methyl-2-methylsulfanylphenyl)prop-2-enoic acid Traditional Name: (E)-3-[5-methyl-2-(methylthio)phenyl]acrylic acid Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC)C=CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)SC)/C=C/C(=O)O

InChI

InChI=1S/C11H12O2S/c1-8-3-5-10(14-2)9(7-8)4-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-4+