6-[[4-[[6-(dioxidanyl)-6-oxidanylidene-hexyl]carbamoyl]phenyl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[4-[[6-(dioxidanyl)-6-oxidanylidene-hexyl]carbamoyl]phenyl]carbonylamino]hexanoic acid Openeye Name: 6-[[4-[(6-hydroperoxy-6-oxo-hexyl)carbamoyl]benzoyl]amino]hexanoic acid CAS Name: 6-[[[4-[[(6-hydroperoxy-6-oxohexyl)amino]-oxomethyl]phenyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[4-[(6-hydroperoxy-6-oxohexyl)carbamoyl]benzoyl]amino]hexanoic acid Traditional Name: 6-[[4-[(6-hydroperoxy-6-keto-hexyl)carbamoyl]benzoyl]amino]hexanoic acid Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCCCC(=O)O)C(=O)NCCCCCC(=O)OO

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCCCC(=O)O)C(=O)NCCCCCC(=O)OO

InChI

InChI=1S/C20H28N2O7/c23-17(24)7-3-1-5-13-21-19(26)15-9-11-16(12-10-15)20(27)22-14-6-2-4-8-18(25)29-28/h9-12,28H,1-8,13-14H2,(H,21,26)(H,22,27)(H,23,24)