(4-phenoxyphenyl) 2,4,6-trimethylbenzenesulfonate

Systemtic Name: (4-phenoxyphenyl) 2,4,6-trimethylbenzenesulfonate Openeye Name: (4-phenoxyphenyl) 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid (4-phenoxyphenyl) ester IUPAC Name: (4-phenoxyphenyl) 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid (4-phenoxyphenyl) ester Formula: C21H20O4S MolecularWeight: 368.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C21H20O4S/c1-15-13-16(2)21(17(3)14-15)26(22,23)25-20-11-9-19(10-12-20)24-18-7-5-4-6-8-18/h4-14H,1-3H3