3-phenylpropyl 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonate

Systemtic Name: 3-phenylpropyl 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonate Openeye Name: 3-phenylpropyl 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonate CAS Name: 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonate Traditional Name: 5-tert-butyl-2-(2-methoxyethoxy)benzenesulfonic acid 3-phenylpropyl ester Formula: C22H30O5S MolecularWeight: 406.5356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCOC)S(=O)(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCOC)S(=O)(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C22H30O5S/c1-22(2,3)19-12-13-20(26-16-15-25-4)21(17-19)28(23,24)27-14-8-11-18-9-6-5-7-10-18/h5-7,9-10,12-13,17H,8,11,14-16H2,1-4H3