8-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]octanoic acid Openeye Name: 8-[(5-bromo-2-hydroxy-benzoyl)amino]octanoic acid CAS Name: 8-[[(5-bromo-2-hydroxyphenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(5-bromo-2-hydroxybenzoyl)amino]octanoic acid Traditional Name: 8-[(5-bromo-2-hydroxy-benzoyl)amino]caprylic acid Formula: C15H20BrNO4 MolecularWeight: 358.2276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)NCCCCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)NCCCCCCCC(=O)O)O

InChI

InChI=1S/C15H20BrNO4/c16-11-7-8-13(18)12(10-11)15(21)17-9-5-3-1-2-4-6-14(19)20/h7-8,10,18H,1-6,9H2,(H,17,21)(H,19,20)