methyl 2-(7-bromanylheptylsulfonyl)benzoate

Systemtic Name: methyl 2-(7-bromanylheptylsulfonyl)benzoate Openeye Name: methyl 2-(7-bromoheptylsulfonyl)benzoate CAS Name: 2-(7-bromoheptylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 2-(7-bromoheptylsulfonyl)benzoate Traditional Name: 2-(7-bromoheptylsulfonyl)benzoic acid methyl ester Formula: C15H21BrO4S MolecularWeight: 377.29384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)CCCCCCCBr

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)CCCCCCCBr

InChI

InChI=1S/C15H21BrO4S/c1-20-15(17)13-9-5-6-10-14(13)21(18,19)12-8-4-2-3-7-11-16/h5-6,9-10H,2-4,7-8,11-12H2,1H3