2-[(1S,2R)-2-ethylcyclopropyl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(1S,2R)-2-ethylcyclopropyl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[(1S,2R)-2-ethylcyclopropyl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[(1S,2R)-2-ethylcyclopropyl]ethyl ester IUPAC Name: 2-[(1S,2R)-2-ethylcyclopropyl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[(1S,2R)-2-ethylcyclopropyl]ethyl ester Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC1CCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC[C@@H]1C[C@H]1CCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H20O3S/c1-3-12-10-13(12)8-9-17-18(15,16)14-6-4-11(2)5-7-14/h4-7,12-13H,3,8-10H2,1-2H3/t12-,13-/m1/s1