ethyl 3-bromanyl-4-[4-(3-oxidanylidenebutyl)phenoxy]sulfonyl-benzoate

Systemtic Name: ethyl 3-bromanyl-4-[4-(3-oxidanylidenebutyl)phenoxy]sulfonyl-benzoate Openeye Name: ethyl 3-bromo-4-[4-(3-oxobutyl)phenoxy]sulfonyl-benzoate CAS Name: 3-bromo-4-[4-(3-oxobutyl)phenoxy]sulfonylbenzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[4-(3-oxobutyl)phenoxy]sulfonylbenzoate Traditional Name: 3-bromo-4-[4-(3-ketobutyl)phenoxy]sulfonyl-benzoic acid ethyl ester Formula: C19H19BrO6S MolecularWeight: 455.31956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CCC(=O)C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CCC(=O)C)Br

InChI

InChI=1S/C19H19BrO6S/c1-3-25-19(22)15-8-11-18(17(20)12-15)27(23,24)26-16-9-6-14(7-10-16)5-4-13(2)21/h6-12H,3-5H2,1-2H3