2,7-dimethyl-3-phenylsulfanyl-oct-3-en-5-yne-2,7-diol

Systemtic Name: 2,7-dimethyl-3-phenylsulfanyl-oct-3-en-5-yne-2,7-diol Openeye Name: 2,7-dimethyl-3-phenylsulfanyl-oct-3-en-5-yne-2,7-diol CAS Name: 2,7-dimethyl-3-(phenylthio)oct-3-en-5-yne-2,7-diol IUPAC Name: 2,7-dimethyl-3-phenylsulfanyloct-3-en-5-yne-2,7-diol Traditional Name: 2,7-dimethyl-3-(phenylthio)oct-3-en-5-yne-2,7-diol Formula: C16H20O2S MolecularWeight: 276.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC=C(C(C)(C)O)SC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C#CC=C(C(C)(C)O)SC1=CC=CC=C1)O

InChI

InChI=1S/C16H20O2S/c1-15(2,17)12-8-11-14(16(3,4)18)19-13-9-6-5-7-10-13/h5-7,9-11,17-18H,1-4H3