[2-(furan-2-yl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(furan-2-yl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(2-furyl)-2-oxo-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-furanyl)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-yl)-2-oxoethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(2-furyl)-2-keto-ethyl] ester Formula: C13H12O5S MolecularWeight: 280.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=CO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=CO2

InChI

InChI=1S/C13H12O5S/c1-10-4-6-11(7-5-10)19(15,16)18-9-12(14)13-3-2-8-17-13/h2-8H,9H2,1H3