4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)pyrrolidin-1-yl]-4-oxidanylidene-butanethial

Systemtic Name: 4-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)pyrrolidin-1-yl]-4-oxidanylidene-butanethial Openeye Name: 4-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrolidin-1-yl]-4-oxo-butanethial CAS Name: 4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-1-pyrrolidinyl]-4-oxobutanethial IUPAC Name: 4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)pyrrolidin-1-yl]-4-oxobutanethial Traditional Name: 4-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrolidino]-4-keto-thiobutyraldehyde Formula: C22H33NO2S MolecularWeight: 375.56792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2CCCN2C(=O)CCC=S

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2CCCN2C(=O)CCC=S

InChI

InChI=1S/C22H33NO2S/c1-21(2,3)16-13-15(14-17(20(16)25)22(4,5)6)18-9-7-11-23(18)19(24)10-8-12-26/h12-14,18,25H,7-11H2,1-6H3