2-(3-oxidanyl-2-phenylsulfanyl-cyclopent-2-en-1-yl)ethanenitrile

Systemtic Name: 2-(3-oxidanyl-2-phenylsulfanyl-cyclopent-2-en-1-yl)ethanenitrile Openeye Name: 2-(3-hydroxy-2-phenylsulfanyl-cyclopent-2-en-1-yl)acetonitrile CAS Name: 2-[3-hydroxy-2-(phenylthio)-1-cyclopent-2-enyl]acetonitrile IUPAC Name: 2-(3-hydroxy-2-phenylsulfanylcyclopent-2-en-1-yl)acetonitrile Traditional Name: 2-[3-hydroxy-2-(phenylthio)cyclopent-2-en-1-yl]acetonitrile Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1CC#N)SC2=CC=CC=C2)O

Isomeric SMILES

C1CC(=C(C1CC#N)SC2=CC=CC=C2)O

InChI

InChI=1S/C13H13NOS/c14-9-8-10-6-7-12(15)13(10)16-11-4-2-1-3-5-11/h1-5,10,15H,6-8H2