2-[2,2-bis(chloranyl)ethanoyl-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromanylethanoate

Systemtic Name: 2-[2,2-bis(chloranyl)ethanoyl-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromanylethanoate Openeye Name: 2-[(2,2-dichloroacetyl)-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromoacetate CAS Name: 2-bromoacetic acid 2-[(2,2-dichloro-1-oxoethyl)-[(4-methylsulfonylphenyl)methyl]amino]ethyl ester IUPAC Name: 2-[(2,2-dichloroacetyl)-[(4-methylsulfonylphenyl)methyl]amino]ethyl 2-bromoacetate Traditional Name: 2-bromoacetic acid 2-[(2,2-dichloroacetyl)-(4-mesylbenzyl)amino]ethyl ester Formula: C14H16BrCl2NO5S MolecularWeight: 461.15554

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN(CCOC(=O)CBr)C(=O)C(Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN(CCOC(=O)CBr)C(=O)C(Cl)Cl

InChI

InChI=1S/C14H16BrCl2NO5S/c1-24(21,22)11-4-2-10(3-5-11)9-18(14(20)13(16)17)6-7-23-12(19)8-15/h2-5,13H,6-9H2,1H3