[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(2-methoxyphenyl)-2-oxo-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyphenyl)-2-oxoethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-keto-2-(2-methoxyphenyl)ethyl] ester Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C16H16O5S/c1-12-7-9-13(10-8-12)22(18,19)21-11-15(17)14-5-3-4-6-16(14)20-2/h3-10H,11H2,1-2H3