[2-(2-oxidanylidene-1-phenylmethoxy-propyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(2-oxidanylidene-1-phenylmethoxy-propyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2-(1-benzyloxy-2-oxo-propyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-oxo-1-phenylmethoxypropyl)phenyl] ester IUPAC Name: [2-(2-oxo-1-phenylmethoxypropyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(1-benzoxy-2-keto-propyl)phenyl] ester Formula: C23H22O5S MolecularWeight: 410.48278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(C(=O)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(C(=O)C)OCC3=CC=CC=C3

InChI

InChI=1S/C23H22O5S/c1-17-12-14-20(15-13-17)29(25,26)28-22-11-7-6-10-21(22)23(18(2)24)27-16-19-8-4-3-5-9-19/h3-15,23H,16H2,1-2H3