[(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxy-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxy-ethyl] 4-methylbenzenesulfonate Openeye Name: [(1S)-2-benzyloxy-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxyethyl] ester IUPAC Name: [(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxyethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S)-2-benzoxy-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl] ester Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(COCC2=CC=CC=C2)C3COC(O3)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](COCC2=CC=CC=C2)[C@@H]3COC(O3)(C)C

InChI

InChI=1S/C21H26O6S/c1-16-9-11-18(12-10-16)28(22,23)27-20(19-15-25-21(2,3)26-19)14-24-13-17-7-5-4-6-8-17/h4-12,19-20H,13-15H2,1-3H3/t19-,20-/m0/s1