(4-methylphenyl)-oxidanylidene-methanesulfonate

Systemtic Name: (4-methylphenyl)-oxidanylidene-methanesulfonate Openeye Name: oxo(p-tolyl)methanesulfonate CAS Name: (4-methylphenyl)-oxomethanesulfonate IUPAC Name: (4-methylphenyl)-oxomethanesulfonate Traditional Name: keto(p-tolyl)methanesulfonate Formula: C8H7O4S- MolecularWeight: 199.20378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8O4S/c1-6-2-4-7(5-3-6)8(9)13(10,11)12/h2-5H,1H3,(H,10,11,12)/p-1