8-[3-(8-oxidanidyl-8-oxidanylidene-octyl)-2-benzofuran-4-yl]octanoate

Systemtic Name: 8-[3-(8-oxidanidyl-8-oxidanylidene-octyl)-2-benzofuran-4-yl]octanoate Openeye Name: 8-[3-(8-oxido-8-oxo-octyl)isobenzofuran-4-yl]octanoate CAS Name: 8-[3-(8-oxido-8-oxooctyl)-4-isobenzofuranyl]octanoate IUPAC Name: 8-[3-(8-oxido-8-oxooctyl)-2-benzofuran-4-yl]octanoate Traditional Name: 8-[3-(8-keto-8-oxido-octyl)isobenzofuran-4-yl]caprylate Formula: C24H32O5-2 MolecularWeight: 400.50788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=COC(=C2C(=C1)CCCCCCCC(=O)[O-])CCCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC2=COC(=C2C(=C1)CCCCCCCC(=O)[O-])CCCCCCCC(=O)[O-]

InChI

InChI=1S/C24H34O5/c25-22(26)16-9-5-1-3-7-12-19-13-11-14-20-18-29-21(24(19)20)15-8-4-2-6-10-17-23(27)28/h11,13-14,18H,1-10,12,15-17H2,(H,25,26)(H,27,28)/p-2