(E)-3-(3-sulfanylphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-sulfanylphenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-sulfanylphenyl)prop-2-enoic acid CAS Name: (E)-3-(3-mercaptophenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-sulfanylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-mercaptophenyl)acrylic acid Formula: C9H8O2S MolecularWeight: 180.22362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S)/C=C/C(=O)O

InChI

InChI=1S/C9H8O2S/c10-9(11)5-4-7-2-1-3-8(12)6-7/h1-6,12H,(H,10,11)/b5-4+