[3,3-dimethylbut-1-ynyl(phenyl)-$l^{3}-iodanyl] benzenesulfonate

Systemtic Name: [3,3-dimethylbut-1-ynyl(phenyl)-$l^{3}-iodanyl] benzenesulfonate Openeye Name: [3,3-dimethylbut-1-ynyl(phenyl)-$l^{3}-iodanyl] benzenesulfonate CAS Name: benzenesulfonic acid [3,3-dimethylbut-1-ynyl(phenyl)-$l^{3}-iodanyl] ester IUPAC Name: [3,3-dimethylbut-1-ynyl(phenyl)-$l^{3}-iodanyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3,3-dimethylbut-1-ynyl(phenyl)iodinanyl] ester Formula: C18H19IO3S MolecularWeight: 442.31113

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CI(C1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C#CI(C1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19IO3S/c1-18(2,3)14-15-19(16-10-6-4-7-11-16)22-23(20,21)17-12-8-5-9-13-17/h4-13H,1-3H3