(2-methyl-6-phenoxy-hexyl) 4-methylbenzenesulfonate

Systemtic Name: (2-methyl-6-phenoxy-hexyl) 4-methylbenzenesulfonate Openeye Name: (2-methyl-6-phenoxy-hexyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-methyl-6-phenoxyhexyl) ester IUPAC Name: (2-methyl-6-phenoxyhexyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-methyl-6-phenoxy-hexyl) ester Formula: C20H26O4S MolecularWeight: 362.48304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CCCCOC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CCCCOC2=CC=CC=C2

InChI

InChI=1S/C20H26O4S/c1-17-11-13-20(14-12-17)25(21,22)24-16-18(2)8-6-7-15-23-19-9-4-3-5-10-19/h3-5,9-14,18H,6-8,15-16H2,1-2H3