ethyl 4-bromanyl-5-ethylsulfonyl-2-methyl-benzoate

Systemtic Name: ethyl 4-bromanyl-5-ethylsulfonyl-2-methyl-benzoate Openeye Name: ethyl 4-bromo-5-ethylsulfonyl-2-methyl-benzoate CAS Name: 4-bromo-5-ethylsulfonyl-2-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-bromo-5-ethylsulfonyl-2-methylbenzoate Traditional Name: 4-bromo-5-esyl-2-methyl-benzoic acid ethyl ester Formula: C12H15BrO4S MolecularWeight: 335.2141

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1C)Br)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1C)Br)S(=O)(=O)CC

InChI

InChI=1S/C12H15BrO4S/c1-4-17-12(14)9-7-11(18(15,16)5-2)10(13)6-8(9)3/h6-7H,4-5H2,1-3H3