3-[7-octoxy-2-(3-oxidanidyl-3-oxidanylidene-propyl)-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoate

Systemtic Name: 3-[7-octoxy-2-(3-oxidanidyl-3-oxidanylidene-propyl)-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoate Openeye Name: 3-[7-octoxy-2-(3-oxido-3-oxo-propyl)-4-oxo-8-propyl-chroman-2-yl]propanoate CAS Name: 3-[7-octoxy-2-(3-oxido-3-oxopropyl)-4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoate IUPAC Name: 3-[7-octoxy-2-(3-oxido-3-oxopropyl)-4-oxo-8-propyl-3H-chromen-2-yl]propanoate Traditional Name: 3-[4-keto-2-(3-keto-3-oxido-propyl)-7-octoxy-8-propyl-chroman-2-yl]propionate Formula: C26H36O7-2 MolecularWeight: 460.55984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C1)C(=O)CC(O2)(CCC(=O)[O-])CCC(=O)[O-])CCC

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C1)C(=O)CC(O2)(CCC(=O)[O-])CCC(=O)[O-])CCC

InChI

InChI=1S/C26H38O7/c1-3-5-6-7-8-9-17-32-22-12-11-19-21(27)18-26(15-13-23(28)29,16-14-24(30)31)33-25(19)20(22)10-4-2/h11-12H,3-10,13-18H2,1-2H3,(H,28,29)(H,30,31)/p-2