2-[(4R)-5,5-dimethyl-4-(2-oxidanylideneethyl)cyclopenten-1-yl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(4R)-5,5-dimethyl-4-(2-oxidanylideneethyl)cyclopenten-1-yl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[(4R)-5,5-dimethyl-4-(2-oxoethyl)cyclopenten-1-yl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[(4R)-5,5-dimethyl-4-(2-oxoethyl)-1-cyclopentenyl]ethyl ester IUPAC Name: 2-[(4R)-5,5-dimethyl-4-(2-oxoethyl)cyclopenten-1-yl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[(4R)-4-(2-ketoethyl)-5,5-dimethyl-cyclopenten-1-yl]ethyl ester Formula: C18H24O4S MolecularWeight: 336.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CCC(C2(C)C)CC=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC[C@@H](C2(C)C)CC=O

InChI

InChI=1S/C18H24O4S/c1-14-4-8-17(9-5-14)23(20,21)22-13-11-16-7-6-15(10-12-19)18(16,2)3/h4-5,7-9,12,15H,6,10-11,13H2,1-3H3/t15-/m1/s1