3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]propanenitrile

Systemtic Name: 3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]propanenitrile Openeye Name: 3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylsulfanyl]propanenitrile CAS Name: 3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylthio]propanenitrile IUPAC Name: 3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]propanenitrile Traditional Name: 3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylthio]propionitrile Formula: C20H31NOS MolecularWeight: 333.53124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCCC#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCCC#N

InChI

InChI=1S/C20H31NOS/c1-19(2,3)16-13-15(9-7-11-23-12-8-10-21)14-17(18(16)22)20(4,5)6/h13-14,22H,7-9,11-12H2,1-6H3