4-[2,4-bis(2-methylbutan-2-yl)phenoxy]pyrrolidin-2-one

Systemtic Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]pyrrolidin-2-one Openeye Name: 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]pyrrolidin-2-one CAS Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-pyrrolidinone IUPAC Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]pyrrolidin-2-one Traditional Name: 4-(2,4-ditert-amylphenoxy)-2-pyrrolidone Formula: C20H31NO2 MolecularWeight: 317.46564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC2CC(=O)NC2)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC2CC(=O)NC2)C(C)(C)CC

InChI

InChI=1S/C20H31NO2/c1-7-19(3,4)14-9-10-17(16(11-14)20(5,6)8-2)23-15-12-18(22)21-13-15/h9-11,15H,7-8,12-13H2,1-6H3,(H,21,22)