benzene; (E)-3-sulfanylprop-2-enoic acid

Systemtic Name: benzene; (E)-3-sulfanylprop-2-enoic acid Openeye Name: benzene; (E)-3-sulfanylprop-2-enoic acid CAS Name: benzene; (E)-3-mercapto-2-propenoic acid IUPAC Name: benzene; (E)-3-sulfanylprop-2-enoic acid Traditional Name: benzene; (E)-3-mercaptoacrylic acid Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CC=C1.C(=CS)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C6H6.C3H4O2S/c1-2-4-6-5-3-1;4-3(5)1-2-6/h1-6H;1-2,6H,(H,4,5)/b;2-1+