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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=S)C(=O)N1CCCC1C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C=S)C(=O)N1CCCC1C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C22H33NO2S/c1-14(13-26)20(25)23-10-8-9-18(23)15-11-16(21(2,3)4)19(24)17(12-15)22(5,6)7/h11-14,18,24H,8-10H2,1-7H3