[(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethyl-cyclobutyl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethyl-cyclobutyl]methyl 4-methylbenzenesulfonate Openeye Name: [(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethyl-cyclobutyl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethylcyclobutyl]methyl ester IUPAC Name: [(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethylcyclobutyl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-(1-ethoxyethoxy)-3,3-dimethyl-cyclobutyl]methyl ester Formula: C18H28O5S MolecularWeight: 356.47692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OC1C(CC1(C)C)COS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(C)O[C@H]1[C@@H](CC1(C)C)COS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H28O5S/c1-6-21-14(3)23-17-15(11-18(17,4)5)12-22-24(19,20)16-9-7-13(2)8-10-16/h7-10,14-15,17H,6,11-12H2,1-5H3/t14?,15-,17-/m0/s1