4-iodanylpentan-2-yl naphthalene-1-sulfonate

Systemtic Name: 4-iodanylpentan-2-yl naphthalene-1-sulfonate Openeye Name: (3-iodo-1-methyl-butyl) naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid 4-iodopentan-2-yl ester IUPAC Name: 4-iodopentan-2-yl naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid (3-iodo-1-methyl-butyl) ester Formula: C15H17IO3S MolecularWeight: 404.26315

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)I)OS(=O)(=O)C1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(CC(C)I)OS(=O)(=O)C1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C15H17IO3S/c1-11(16)10-12(2)19-20(17,18)15-9-5-7-13-6-3-4-8-14(13)15/h3-9,11-12H,10H2,1-2H3