(E)-3-(2-ethylsulfanylphenyl)-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-(2-ethylsulfanylphenyl)-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-(2-ethylsulfanylphenyl)-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2-(ethylthio)phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-(2-ethylsulfanylphenyl)-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2-(ethylthio)phenyl]-2-methyl-acrylic acid Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C=C(C)C(=O)O

Isomeric SMILES

CCSC1=CC=CC=C1/C=C(\C)/C(=O)O

InChI

InChI=1S/C12H14O2S/c1-3-15-11-7-5-4-6-10(11)8-9(2)12(13)14/h4-8H,3H2,1-2H3,(H,13,14)/b9-8+