8-[[2,3-bis(oxidanyl)phenyl]carbonylamino]octanoic acid

Systemtic Name: 8-[[2,3-bis(oxidanyl)phenyl]carbonylamino]octanoic acid Openeye Name: 8-[(2,3-dihydroxybenzoyl)amino]octanoic acid CAS Name: 8-[[(2,3-dihydroxyphenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2,3-dihydroxybenzoyl)amino]octanoic acid Traditional Name: 8-[(2,3-dihydroxybenzoyl)amino]caprylic acid Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5/c17-12-8-6-7-11(14(12)20)15(21)16-10-5-3-1-2-4-9-13(18)19/h6-8,17,20H,1-5,9-10H2,(H,16,21)(H,18,19)