1,5,9,13-tetraoxacyclohexadec-3-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 1,5,9,13-tetraoxacyclohexadec-3-ylmethyl 4-methylbenzenesulfonate Openeye Name: 1,5,9,13-tetraoxacyclohexadec-3-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1,5,9,13-tetraoxacyclohexadec-3-ylmethyl ester IUPAC Name: 1,5,9,13-tetraoxacyclohexadec-3-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1,5,9,13-tetraoxacyclohexadec-3-ylmethyl ester Formula: C20H32O7S MolecularWeight: 416.52888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COCCCOCCCOCCCOC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COCCCOCCCOCCCOC2

InChI

InChI=1S/C20H32O7S/c1-18-5-7-20(8-6-18)28(21,22)27-17-19-15-25-13-3-11-23-9-2-10-24-12-4-14-26-16-19/h5-8,19H,2-4,9-17H2,1H3