3-(2-bromanyl-3-oxidanylidene-cyclopenten-1-yl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(2-bromanyl-3-oxidanylidene-cyclopenten-1-yl)propyl 4-methylbenzenesulfonate Openeye Name: 3-(2-bromo-3-oxo-cyclopenten-1-yl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(2-bromo-3-oxo-1-cyclopentenyl)propyl ester IUPAC Name: 3-(2-bromo-3-oxocyclopenten-1-yl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(2-bromo-3-keto-cyclopenten-1-yl)propyl ester Formula: C15H17BrO4S MolecularWeight: 373.26208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=C(C(=O)CC2)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=C(C(=O)CC2)Br

InChI

InChI=1S/C15H17BrO4S/c1-11-4-7-13(8-5-11)21(18,19)20-10-2-3-12-6-9-14(17)15(12)16/h4-5,7-8H,2-3,6,9-10H2,1H3