(E)-2-phenylsulfanylhex-2-en-4-yne-1,6-diol

Systemtic Name: (E)-2-phenylsulfanylhex-2-en-4-yne-1,6-diol Openeye Name: (E)-2-phenylsulfanylhex-2-en-4-yne-1,6-diol CAS Name: (E)-2-(phenylthio)hex-2-en-4-yne-1,6-diol IUPAC Name: (E)-2-phenylsulfanylhex-2-en-4-yne-1,6-diol Traditional Name: (E)-2-(phenylthio)hex-2-en-4-yne-1,6-diol Formula: C12H12O2S MolecularWeight: 220.28748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(=CC#CCO)CO

Isomeric SMILES

C1=CC=C(C=C1)S/C(=C/C#CCO)/CO

InChI

InChI=1S/C12H12O2S/c13-9-5-4-8-12(10-14)15-11-6-2-1-3-7-11/h1-3,6-8,13-14H,9-10H2/b12-8+