2-(3-iodanylprop-2-ynyl)-4-methyl-benzenesulfonate

Systemtic Name: 2-(3-iodanylprop-2-ynyl)-4-methyl-benzenesulfonate Openeye Name: 2-(3-iodoprop-2-ynyl)-4-methyl-benzenesulfonate CAS Name: 2-(3-iodoprop-2-ynyl)-4-methylbenzenesulfonate IUPAC Name: 2-(3-iodoprop-2-ynyl)-4-methylbenzenesulfonate Traditional Name: 2-(3-iodoprop-2-ynyl)-4-methyl-besylate Formula: C10H8IO3S- MolecularWeight: 335.13819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC#CI

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC#CI

InChI

InChI=1S/C10H9IO3S/c1-8-4-5-10(15(12,13)14)9(7-8)3-2-6-11/h4-5,7H,3H2,1H3,(H,12,13,14)/p-1