(4-methylphenyl) 1,4,7-trioxa-10-azacyclododecane-10-sulfonate

Systemtic Name: (4-methylphenyl) 1,4,7-trioxa-10-azacyclododecane-10-sulfonate Openeye Name: p-tolyl 1,4,7-trioxa-10-azacyclododecane-10-sulfonate CAS Name: 1,4,7-trioxa-10-azacyclododecane-10-sulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 1,4,7-trioxa-10-azacyclododecane-10-sulfonate Traditional Name: 1,4,7-trioxa-10-azacyclododecane-10-sulfonic acid p-tolyl ester Formula: C15H23NO6S MolecularWeight: 345.41122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)N2CCOCCOCCOCC2

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)N2CCOCCOCCOCC2

InChI

InChI=1S/C15H23NO6S/c1-14-2-4-15(5-3-14)22-23(17,18)16-6-8-19-10-12-21-13-11-20-9-7-16/h2-5H,6-13H2,1H3