4-[4-[2-[(4-bromophenyl)sulfonylamino]ethyl]phenyl]-4-oxidanyl-butanoate

Systemtic Name: 4-[4-[2-[(4-bromophenyl)sulfonylamino]ethyl]phenyl]-4-oxidanyl-butanoate Openeye Name: 4-[4-[2-[(4-bromophenyl)sulfonylamino]ethyl]phenyl]-4-hydroxy-butanoate CAS Name: 4-[4-[2-[(4-bromophenyl)sulfonylamino]ethyl]phenyl]-4-hydroxybutanoate IUPAC Name: 4-[4-[2-[(4-bromophenyl)sulfonylamino]ethyl]phenyl]-4-hydroxybutanoate Traditional Name: 4-[4-[2-(brosylamino)ethyl]phenyl]-4-hydroxy-butyrate Formula: C18H19BrNO5S- MolecularWeight: 441.31616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(C=C2)Br)C(CCC(=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(C=C2)Br)C(CCC(=O)[O-])O

InChI

InChI=1S/C18H20BrNO5S/c19-15-5-7-16(8-6-15)26(24,25)20-12-11-13-1-3-14(4-2-13)17(21)9-10-18(22)23/h1-8,17,20-21H,9-12H2,(H,22,23)/p-1