tert-butylbenzene; 1-iodanyl-2-(2-iodanylethynylsulfonyl)ethyne

Systemtic Name: tert-butylbenzene; 1-iodanyl-2-(2-iodanylethynylsulfonyl)ethyne Openeye Name: tert-butylbenzene; 1-iodo-2-(2-iodoethynylsulfonyl)acetylene CAS Name: tert-butylbenzene; 1-iodo-2-(2-iodoethynylsulfonyl)ethyne IUPAC Name: tert-butylbenzene; 1-iodo-2-(2-iodoethynylsulfonyl)ethyne Traditional Name: tert-butylbenzene; 1-iodo-2-(2-iodoethynylsulfonyl)acetylene Formula: C14H14I2O2S MolecularWeight: 500.1337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1.C(#CI)S(=O)(=O)C#CI

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1.C(#CI)S(=O)(=O)C#CI

InChI

InChI=1S/C10H14.C4I2O2S/c1-10(2,3)9-7-5-4-6-8-9;5-1-3-9(7,8)4-2-6/h4-8H,1-3H3;