6-[[2,5-bis(oxidanyl)phenyl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[2,5-bis(oxidanyl)phenyl]carbonylamino]hexanoic acid Openeye Name: 6-[(2,5-dihydroxybenzoyl)amino]hexanoic acid CAS Name: 6-[[(2,5-dihydroxyphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(2,5-dihydroxybenzoyl)amino]hexanoic acid Traditional Name: 6-(gentisoylamino)hexanoic acid Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C(=O)NCCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1O)C(=O)NCCCCCC(=O)O)O

InChI

InChI=1S/C13H17NO5/c15-9-5-6-11(16)10(8-9)13(19)14-7-3-1-2-4-12(17)18/h5-6,8,15-16H,1-4,7H2,(H,14,19)(H,17,18)