2-(4-bromanyl-2-methanoyl-phenoxy)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(4-bromanyl-2-methanoyl-phenoxy)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(4-bromo-2-formyl-phenoxy)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(4-bromo-2-formylphenoxy)ethyl ester IUPAC Name: 2-(4-bromo-2-formylphenoxy)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(4-bromo-2-formyl-phenoxy)ethyl ester Formula: C16H15BrO5S MolecularWeight: 399.2563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=C(C=C(C=C2)Br)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=C(C=C(C=C2)Br)C=O

InChI

InChI=1S/C16H15BrO5S/c1-12-2-5-15(6-3-12)23(19,20)22-9-8-21-16-7-4-14(17)10-13(16)11-18/h2-7,10-11H,8-9H2,1H3