8-[(4-bromophenyl)sulfonylamino]octanoic acid

Systemtic Name: 8-[(4-bromophenyl)sulfonylamino]octanoic acid Openeye Name: 8-[(4-bromophenyl)sulfonylamino]octanoic acid CAS Name: 8-[(4-bromophenyl)sulfonylamino]octanoic acid IUPAC Name: 8-[(4-bromophenyl)sulfonylamino]octanoic acid Traditional Name: 8-(brosylamino)caprylic acid Formula: C14H20BrNO4S MolecularWeight: 378.2819

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)NCCCCCCCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)NCCCCCCCC(=O)O)Br

InChI

InChI=1S/C14H20BrNO4S/c15-12-7-9-13(10-8-12)21(19,20)16-11-5-3-1-2-4-6-14(17)18/h7-10,16H,1-6,11H2,(H,17,18)