3-[(4-tert-butylphenyl)methyl]-1-(trichloromethylsulfanyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]-1-(trichloromethylsulfanyl)pyrrolidine-2,5-dione Openeye Name: 3-[(4-tert-butylphenyl)methyl]-1-(trichloromethylsulfanyl)pyrrolidine-2,5-dione CAS Name: 3-[(4-tert-butylphenyl)methyl]-1-(trichloromethylthio)pyrrolidine-2,5-dione IUPAC Name: 3-[(4-tert-butylphenyl)methyl]-1-(trichloromethylsulfanyl)pyrrolidine-2,5-dione Traditional Name: 3-(4-tert-butylbenzyl)-1-(trichloromethylthio)pyrrolidine-2,5-quinone Formula: C16H18Cl3NO2S MolecularWeight: 394.74362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC2CC(=O)N(C2=O)SC(Cl)(Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CC2CC(=O)N(C2=O)SC(Cl)(Cl)Cl

InChI

InChI=1S/C16H18Cl3NO2S/c1-15(2,3)12-6-4-10(5-7-12)8-11-9-13(21)20(14(11)22)23-16(17,18)19/h4-7,11H,8-9H2,1-3H3