3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanenitrile

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpropanenitrile Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpropanenitrile CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]propanenitrile IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropanenitrile Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]propionitrile Formula: C17H25NOS MolecularWeight: 291.4515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NOS/c1-16(2,3)13-10-12(20-9-7-8-18)11-14(15(13)19)17(4,5)6/h10-11,19H,7,9H2,1-6H3