2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate

Systemtic Name: 2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate Openeye Name: 2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate CAS Name: 2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate IUPAC Name: 2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate Traditional Name: 2-[2-(4-methylphenoxy)ethylsulfonyl]benzoate Formula: C16H15O5S- MolecularWeight: 319.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C16H16O5S/c1-12-6-8-13(9-7-12)21-10-11-22(19,20)15-5-3-2-4-14(15)16(17)18/h2-9H,10-11H2,1H3,(H,17,18)/p-1