3-[3-(2-methoxyethylsulfanyl)propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-(2-methoxyethylsulfanyl)propoxy]benzenecarbonitrile Openeye Name: 3-[3-(2-methoxyethylsulfanyl)propoxy]benzonitrile CAS Name: 3-[3-(2-methoxyethylthio)propoxy]benzonitrile IUPAC Name: 3-[3-(2-methoxyethylsulfanyl)propoxy]benzonitrile Traditional Name: 3-[3-(2-methoxyethylthio)propoxy]benzonitrile Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

COCCSCCCOC1=CC=CC(=C1)C#N

Isomeric SMILES

COCCSCCCOC1=CC=CC(=C1)C#N

InChI

InChI=1S/C13H17NO2S/c1-15-7-9-17-8-3-6-16-13-5-2-4-12(10-13)11-14/h2,4-5,10H,3,6-9H2,1H3