2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl ester IUPAC Name: 2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[(4S)-5,5-diethyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl ester Formula: C18H28O5S MolecularWeight: 356.47692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(OC(O1)(C)C)CCOS(=O)(=O)C2=CC=C(C=C2)C)CC

Isomeric SMILES

CCC1([C@@H](OC(O1)(C)C)CCOS(=O)(=O)C2=CC=C(C=C2)C)CC

InChI

InChI=1S/C18H28O5S/c1-6-18(7-2)16(22-17(4,5)23-18)12-13-21-24(19,20)15-10-8-14(3)9-11-15/h8-11,16H,6-7,12-13H2,1-5H3/t16-/m0/s1