(3-methyl-4-propan-2-yl-phenyl) 4-iodanylbenzenesulfonate

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) 4-iodanylbenzenesulfonate Openeye Name: (4-isopropyl-3-methyl-phenyl) 4-iodobenzenesulfonate CAS Name: 4-iodobenzenesulfonic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) 4-iodobenzenesulfonate Traditional Name: 4-iodobenzenesulfonic acid (4-isopropyl-3-methyl-phenyl) ester Formula: C16H17IO3S MolecularWeight: 416.27385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)I)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)I)C(C)C

InChI

InChI=1S/C16H17IO3S/c1-11(2)16-9-6-14(10-12(16)3)20-21(18,19)15-7-4-13(17)5-8-15/h4-11H,1-3H3