8-[1,3-bis(oxidanylidene)isoindol-4-yl]oxyoctanoic acid

Systemtic Name: 8-[1,3-bis(oxidanylidene)isoindol-4-yl]oxyoctanoic acid Openeye Name: 8-(1,3-dioxoisoindolin-4-yl)oxyoctanoic acid CAS Name: 8-[(1,3-dioxo-4-isoindolyl)oxy]octanoic acid IUPAC Name: 8-(1,3-dioxoisoindol-4-yl)oxyoctanoic acid Traditional Name: 8-(1,3-diketoisoindolin-4-yl)oxycaprylic acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OCCCCCCCC(=O)O)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)OCCCCCCCC(=O)O)C(=O)NC2=O

InChI

InChI=1S/C16H19NO5/c18-13(19)9-4-2-1-3-5-10-22-12-8-6-7-11-14(12)16(21)17-15(11)20/h6-8H,1-5,9-10H2,(H,18,19)(H,17,20,21)